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<a href="FeatureFinderAlgorithmIsotopeWavelet_8h.html">Go to the documentation of this file.</a><div class="fragment"><div class="line"><a name="l00001"></a><span class="lineno">    1</span>&#160;<span class="comment">// --------------------------------------------------------------------------</span></div>
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<div class="line"><a name="l00035"></a><span class="lineno">   35</span>&#160;<span class="preprocessor">#ifndef OPENMS_TRANSFORMATIONS_FEATUREFINDER_FEATUREFINDERALGORITHMISOTOPEWAVELET_H</span></div>
<div class="line"><a name="l00036"></a><span class="lineno">   36</span>&#160;<span class="preprocessor"></span><span class="preprocessor">#define OPENMS_TRANSFORMATIONS_FEATUREFINDER_FEATUREFINDERALGORITHMISOTOPEWAVELET_H</span></div>
<div class="line"><a name="l00037"></a><span class="lineno">   37</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00038"></a><span class="lineno">   38</span>&#160;<span class="preprocessor">#include &lt;<a class="code" href="IsotopeWaveletTransform_8h.html">OpenMS/TRANSFORMATIONS/FEATUREFINDER/IsotopeWaveletTransform.h</a>&gt;</span></div>
<div class="line"><a name="l00039"></a><span class="lineno">   39</span>&#160;<span class="preprocessor">#include &lt;<a class="code" href="FeatureFinderAlgorithm_8h.html">OpenMS/TRANSFORMATIONS/FEATUREFINDER/FeatureFinderAlgorithm.h</a>&gt;</span></div>
<div class="line"><a name="l00040"></a><span class="lineno">   40</span>&#160;<span class="preprocessor">#include &lt;<a class="code" href="ProgressLogger_8h.html">OpenMS/CONCEPT/ProgressLogger.h</a>&gt;</span></div>
<div class="line"><a name="l00041"></a><span class="lineno">   41</span>&#160;<span class="preprocessor">#include &lt;<a class="code" href="FeatureMap_8h.html">OpenMS/KERNEL/FeatureMap.h</a>&gt;</span></div>
<div class="line"><a name="l00042"></a><span class="lineno">   42</span>&#160;<span class="preprocessor">#include &lt;<a class="code" href="MzDataFile_8h.html">OpenMS/FORMAT/MzDataFile.h</a>&gt;</span></div>
<div class="line"><a name="l00043"></a><span class="lineno">   43</span>&#160;<span class="preprocessor">#include &lt;iostream&gt;</span></div>
<div class="line"><a name="l00044"></a><span class="lineno">   44</span>&#160;<span class="preprocessor">#include &lt;time.h&gt;</span></div>
<div class="line"><a name="l00045"></a><span class="lineno">   45</span>&#160;<span class="preprocessor">#include &lt;algorithm&gt;</span></div>
<div class="line"><a name="l00046"></a><span class="lineno">   46</span>&#160;</div>
<div class="line"><a name="l00047"></a><span class="lineno">   47</span>&#160;<span class="preprocessor">#ifdef OPENMS_HAS_TBB</span></div>
<div class="line"><a name="l00048"></a><span class="lineno">   48</span>&#160;<span class="preprocessor"></span><span class="preprocessor">#include &lt;<a class="code" href="IsotopeWaveletParallelFor_8h.html">OpenMS/TRANSFORMATIONS/FEATUREFINDER/IsotopeWaveletParallelFor.h</a>&gt;</span></div>
<div class="line"><a name="l00049"></a><span class="lineno">   49</span>&#160;<span class="preprocessor">#include &lt;tbb/task_scheduler_init.h&gt;</span></div>
<div class="line"><a name="l00050"></a><span class="lineno">   50</span>&#160;<span class="preprocessor">#include &lt;tbb/pipeline.h&gt;</span></div>
<div class="line"><a name="l00051"></a><span class="lineno">   51</span>&#160;<span class="preprocessor">#include &lt;tbb/parallel_for.h&gt;</span></div>
<div class="line"><a name="l00052"></a><span class="lineno">   52</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00053"></a><span class="lineno">   53</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00054"></a><span class="lineno">   54</span>&#160;</div>
<div class="line"><a name="l00055"></a><span class="lineno">   55</span>&#160;<span class="keyword">namespace </span>OpenMS</div>
<div class="line"><a name="l00056"></a><span class="lineno">   56</span>&#160;{</div>
<div class="line"><a name="l00075"></a><span class="lineno">   75</span>&#160;  <span class="keyword">template</span> &lt;<span class="keyword">typename</span> PeakType, <span class="keyword">typename</span> FeatureType&gt;</div>
<div class="line"><a name="l00076"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html">   76</a></span>&#160;  <span class="keyword">class </span><a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html">FeatureFinderAlgorithmIsotopeWavelet</a> :</div>
<div class="line"><a name="l00077"></a><span class="lineno">   77</span>&#160;    <span class="keyword">public</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html">FeatureFinderAlgorithm</a>&lt;PeakType, FeatureType&gt;</div>
<div class="line"><a name="l00078"></a><span class="lineno">   78</span>&#160;  {</div>
<div class="line"><a name="l00079"></a><span class="lineno">   79</span>&#160;<span class="preprocessor">#ifdef OPENMS_HAS_TBB</span></div>
<div class="line"><a name="l00080"></a><span class="lineno">   80</span>&#160;<span class="preprocessor"></span>    <span class="keyword">friend</span> <span class="keyword">class </span><a class="code" href="classOpenMS_1_1IsotopeWaveletParallelFor.html">IsotopeWaveletParallelFor</a>&lt;PeakType, FeatureType&gt;;</div>
<div class="line"><a name="l00081"></a><span class="lineno">   81</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00082"></a><span class="lineno">   82</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00083"></a><span class="lineno">   83</span>&#160;<span class="keyword">public</span>:</div>
<div class="line"><a name="l00084"></a><span class="lineno">   84</span>&#160;</div>
<div class="line"><a name="l00085"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a7837c64b8bc2ae095bf949d6ea9fe2d5">   85</a></span>&#160;    <span class="keyword">typedef</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html">FeatureFinderAlgorithm&lt;PeakType, FeatureType&gt;</a> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a7837c64b8bc2ae095bf949d6ea9fe2d5">Base</a>;</div>
<div class="line"><a name="l00086"></a><span class="lineno">   86</span>&#160;</div>
<div class="line"><a name="l00087"></a><span class="lineno">   87</span>&#160;</div>
<div class="line"><a name="l00089"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3ee942662a8e6bbd9a705201a1896666">   89</a></span>&#160;    <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3ee942662a8e6bbd9a705201a1896666">FeatureFinderAlgorithmIsotopeWavelet</a>()</div>
<div class="line"><a name="l00090"></a><span class="lineno">   90</span>&#160;    {</div>
<div class="line"><a name="l00091"></a><span class="lineno">   91</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;max_charge&quot;</span>, 3, <span class="stringliteral">&quot;The maximal charge state to be considered.&quot;</span>);</div>
<div class="line"><a name="l00092"></a><span class="lineno">   92</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a3a23089ec40eeed796efe7b69ecb02ac">setMinInt</a>(<span class="stringliteral">&quot;max_charge&quot;</span>, 1);</div>
<div class="line"><a name="l00093"></a><span class="lineno">   93</span>&#160;</div>
<div class="line"><a name="l00094"></a><span class="lineno">   94</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;intensity_threshold&quot;</span>, -1., <span class="stringliteral">&quot;The final threshold t&#39; is build upon the formula: t&#39; = av+t*sd, &quot;</span></div>
<div class="line"><a name="l00095"></a><span class="lineno">   95</span>&#160;                                                           <span class="stringliteral">&quot;where t is the intensity_threshold, av the average intensity within the wavelet transformed signal &quot;</span></div>
<div class="line"><a name="l00096"></a><span class="lineno">   96</span>&#160;                                                           <span class="stringliteral">&quot;and sd the standard deviation of the transform. &quot;</span></div>
<div class="line"><a name="l00097"></a><span class="lineno">   97</span>&#160;                                                           <span class="stringliteral">&quot;If you set intensity_threshold=-1, t&#39; will be zero.\n&quot;</span></div>
<div class="line"><a name="l00098"></a><span class="lineno">   98</span>&#160;                                                           <span class="stringliteral">&quot;As the &#39;optimal&#39; value for this parameter is highly data dependent, we would recommend to start &quot;</span></div>
<div class="line"><a name="l00099"></a><span class="lineno">   99</span>&#160;                                                           <span class="stringliteral">&quot;with -1, which will also extract features with very low signal-to-noise ratio. Subsequently, one &quot;</span></div>
<div class="line"><a name="l00100"></a><span class="lineno">  100</span>&#160;                                                           <span class="stringliteral">&quot;might increase the threshold to find an optimized trade-off between false positives and true positives. &quot;</span></div>
<div class="line"><a name="l00101"></a><span class="lineno">  101</span>&#160;                                                           <span class="stringliteral">&quot;Depending on the dynamic range of your spectra, suitable value ranges include: -1, [0:10], and if your data &quot;</span></div>
<div class="line"><a name="l00102"></a><span class="lineno">  102</span>&#160;                                                           <span class="stringliteral">&quot;features even very high intensity values, t can also adopt values up to around 30. &quot;</span></div>
<div class="line"><a name="l00103"></a><span class="lineno">  103</span>&#160;                                                           <span class="stringliteral">&quot;Please note that this parameter is not of an integer type, s.t. you can also use t:=0.1, e.g.&quot;</span>);</div>
<div class="line"><a name="l00104"></a><span class="lineno">  104</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;intensity_type&quot;</span>, <span class="stringliteral">&quot;ref&quot;</span>, <span class="stringliteral">&quot;Determines the intensity type returned for the identified features. &#39;ref&#39; (default) returns the sum of the intensities of each isotopic peak within an isotope pattern. &#39;trans&#39; refers to the intensity of the monoisotopic peak within the wavelet transform. &#39;corrected&#39; refers also to the transformed intensity with an attempt to remove the effects of the convolution. While the latter ones might be preferable for qualitative analyses, &#39;ref&#39; might be the best option to obtain quantitative results. Please note that intensity values might be spoiled (in particular for the option &#39;ref&#39;), as soon as patterns overlap (see also the explanations given in the class documentation of FeatureFinderAlgorihtmIsotopeWavelet).&quot;</span>, <a class="code" href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">StringList::create</a>(<span class="stringliteral">&quot;advanced&quot;</span>));</div>
<div class="line"><a name="l00105"></a><span class="lineno">  105</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a10933782584a46cded91c40574027ee2">setValidStrings</a>(<span class="stringliteral">&quot;intensity_type&quot;</span>, <a class="code" href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">StringList::create</a>(<span class="stringliteral">&quot;ref,trans,corrected&quot;</span>));</div>
<div class="line"><a name="l00106"></a><span class="lineno">  106</span>&#160;</div>
<div class="line"><a name="l00107"></a><span class="lineno">  107</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;check_ppm&quot;</span>, <span class="stringliteral">&quot;false&quot;</span>, <span class="stringliteral">&quot;Enables/disables a ppm test vs. the averagine model, i.e. &quot;</span></div>
<div class="line"><a name="l00108"></a><span class="lineno">  108</span>&#160;                                                     <span class="stringliteral">&quot;potential peptide masses are checked for plausibility. In addition, a heuristic correcting potential mass shifts induced by the wavelet is applied.&quot;</span>, <a class="code" href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">StringList::create</a>(<span class="stringliteral">&quot;advanced&quot;</span>));</div>
<div class="line"><a name="l00109"></a><span class="lineno">  109</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a10933782584a46cded91c40574027ee2">setValidStrings</a>(<span class="stringliteral">&quot;check_ppm&quot;</span>, <a class="code" href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">StringList::create</a>(<span class="stringliteral">&quot;true,false&quot;</span>));</div>
<div class="line"><a name="l00110"></a><span class="lineno">  110</span>&#160;</div>
<div class="line"><a name="l00111"></a><span class="lineno">  111</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;hr_data&quot;</span>, <span class="stringliteral">&quot;false&quot;</span>, <span class="stringliteral">&quot;Must be true in case of high-resolution data, i.e. &quot;</span></div>
<div class="line"><a name="l00112"></a><span class="lineno">  112</span>&#160;                                                   <span class="stringliteral">&quot;for spectra featuring large m/z-gaps (present in FTICR and Orbitrap data, e.g.). Please check &quot;</span></div>
<div class="line"><a name="l00113"></a><span class="lineno">  113</span>&#160;                                                   <span class="stringliteral">&quot;a single MS scan out of your recording, if you are unsure.&quot;</span>);</div>
<div class="line"><a name="l00114"></a><span class="lineno">  114</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a10933782584a46cded91c40574027ee2">setValidStrings</a>(<span class="stringliteral">&quot;hr_data&quot;</span>, <a class="code" href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">StringList::create</a>(<span class="stringliteral">&quot;true,false&quot;</span>));</div>
<div class="line"><a name="l00115"></a><span class="lineno">  115</span>&#160;</div>
<div class="line"><a name="l00116"></a><span class="lineno">  116</span>&#160;<span class="preprocessor">#if (defined(OPENMS_HAS_CUDA) || defined(OPENMS_HAS_TBB))</span></div>
<div class="line"><a name="l00117"></a><span class="lineno">  117</span>&#160;<span class="preprocessor"></span>      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;parallel:use_gpus&quot;</span>, <span class="stringliteral">&quot;-1&quot;</span>, <span class="stringliteral">&quot;A comma-separated list of IDs corresponding to the GPU devices to use.\n&quot;</span></div>
<div class="line"><a name="l00118"></a><span class="lineno">  118</span>&#160;                                                          <span class="stringliteral">&quot;&#39;-1&#39; disables parallelization (CUDA/TBB) at all.\n&quot;</span>);</div>
<div class="line"><a name="l00119"></a><span class="lineno">  119</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00120"></a><span class="lineno">  120</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00121"></a><span class="lineno">  121</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;sweep_line:rt_votes_cutoff&quot;</span>, 5, <span class="stringliteral">&quot;Defines the minimum number of &quot;</span></div>
<div class="line"><a name="l00122"></a><span class="lineno">  122</span>&#160;                                                                <span class="stringliteral">&quot;subsequent scans where a pattern must occur to be considered as a feature.&quot;</span>, <a class="code" href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">StringList::create</a>(<span class="stringliteral">&quot;advanced&quot;</span>));</div>
<div class="line"><a name="l00123"></a><span class="lineno">  123</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a3a23089ec40eeed796efe7b69ecb02ac">setMinInt</a>(<span class="stringliteral">&quot;sweep_line:rt_votes_cutoff&quot;</span>, 0);</div>
<div class="line"><a name="l00124"></a><span class="lineno">  124</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">setValue</a>(<span class="stringliteral">&quot;sweep_line:rt_interleave&quot;</span>, 1, <span class="stringliteral">&quot;Defines the maximum number of &quot;</span></div>
<div class="line"><a name="l00125"></a><span class="lineno">  125</span>&#160;                                                              <span class="stringliteral">&quot;scans (w.r.t. rt_votes_cutoff) where an expected pattern is missing. There is usually no reason to change the default value.&quot;</span>, <a class="code" href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">StringList::create</a>(<span class="stringliteral">&quot;advanced&quot;</span>));</div>
<div class="line"><a name="l00126"></a><span class="lineno">  126</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">defaults_</a>.<a class="code" href="classOpenMS_1_1Param.html#a3a23089ec40eeed796efe7b69ecb02ac">setMinInt</a>(<span class="stringliteral">&quot;sweep_line:rt_interleave&quot;</span>, 0);</div>
<div class="line"><a name="l00127"></a><span class="lineno">  127</span>&#160;</div>
<div class="line"><a name="l00128"></a><span class="lineno">  128</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a2802c591e6d7fd3fd9cc35f5e875d0ba">defaultsToParam_</a>();</div>
<div class="line"><a name="l00129"></a><span class="lineno">  129</span>&#160;    }</div>
<div class="line"><a name="l00130"></a><span class="lineno">  130</span>&#160;</div>
<div class="line"><a name="l00132"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a522648bd9fecc67681ffdbf0a15b3139">  132</a></span>&#160;    <span class="keyword">virtual</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a522648bd9fecc67681ffdbf0a15b3139">~FeatureFinderAlgorithmIsotopeWavelet</a>()</div>
<div class="line"><a name="l00133"></a><span class="lineno">  133</span>&#160;    {</div>
<div class="line"><a name="l00134"></a><span class="lineno">  134</span>&#160;    }</div>
<div class="line"><a name="l00135"></a><span class="lineno">  135</span>&#160;</div>
<div class="line"><a name="l00136"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a512f34fae6d03198dea390c33e52e75d">  136</a></span>&#160;    <span class="keyword">typename</span> <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html">IsotopeWaveletTransform&lt;PeakType&gt;::TransSpectrum</a> * <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a512f34fae6d03198dea390c33e52e75d">prepareHRDataCuda</a>(<span class="keyword">const</span> <a class="code" href="classunsigned_01int.html">UInt</a> i, <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html">IsotopeWaveletTransform&lt;PeakType&gt;</a> * iwt)</div>
<div class="line"><a name="l00137"></a><span class="lineno">  137</span>&#160;    {</div>
<div class="line"><a name="l00138"></a><span class="lineno">  138</span>&#160;      <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> * new_spec(<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a80a937e9a0dd8e9426bd2e0051ecaa33">createHRData</a>(i));</div>
<div class="line"><a name="l00139"></a><span class="lineno">  139</span>&#160;      <span class="keyword">typename</span> <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html">IsotopeWaveletTransform&lt;PeakType&gt;::TransSpectrum</a> * c_trans = <span class="keyword">new</span> <span class="keyword">typename</span> <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html">IsotopeWaveletTransform&lt;PeakType&gt;::TransSpectrum</a>(new_spec);</div>
<div class="line"><a name="l00140"></a><span class="lineno">  140</span>&#160;      iwt-&gt;initializeScanCuda(*new_spec);</div>
<div class="line"><a name="l00141"></a><span class="lineno">  141</span>&#160;</div>
<div class="line"><a name="l00142"></a><span class="lineno">  142</span>&#160;      <span class="keywordflow">return</span> c_trans;</div>
<div class="line"><a name="l00143"></a><span class="lineno">  143</span>&#160;    }</div>
<div class="line"><a name="l00144"></a><span class="lineno">  144</span>&#160;</div>
<div class="line"><a name="l00145"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a80a937e9a0dd8e9426bd2e0051ecaa33">  145</a></span>&#160;    <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> * <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a80a937e9a0dd8e9426bd2e0051ecaa33">createHRData</a>(<span class="keyword">const</span> <a class="code" href="classunsigned_01int.html">UInt</a> i)</div>
<div class="line"><a name="l00146"></a><span class="lineno">  146</span>&#160;    {</div>
<div class="line"><a name="l00147"></a><span class="lineno">  147</span>&#160;      <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> spec((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]);</div>
<div class="line"><a name="l00148"></a><span class="lineno">  148</span>&#160;</div>
<div class="line"><a name="l00149"></a><span class="lineno">  149</span>&#160;      <span class="keyword">const</span> <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> &amp; specr((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]);</div>
<div class="line"><a name="l00150"></a><span class="lineno">  150</span>&#160;</div>
<div class="line"><a name="l00151"></a><span class="lineno">  151</span>&#160;      <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> j = 0; j &lt; spec.size() - 1; ++j)</div>
<div class="line"><a name="l00152"></a><span class="lineno">  152</span>&#160;      {</div>
<div class="line"><a name="l00153"></a><span class="lineno">  153</span>&#160;        spec[j].setMZ(-1 * (specr[j + 1].getMZ() - specr[j].getMZ()));</div>
<div class="line"><a name="l00154"></a><span class="lineno">  154</span>&#160;        spec[j].setIntensity((specr[j].getIntensity() + specr[j + 1].getIntensity()));</div>
<div class="line"><a name="l00155"></a><span class="lineno">  155</span>&#160;      }</div>
<div class="line"><a name="l00156"></a><span class="lineno">  156</span>&#160;      spec[spec.size() - 1].setMZ(-1); spec[spec.size() - 1].setIntensity(-1);</div>
<div class="line"><a name="l00157"></a><span class="lineno">  157</span>&#160;</div>
<div class="line"><a name="l00158"></a><span class="lineno">  158</span>&#160;      <a class="code" href="classOpenMS_1_1ConstRefVector.html">ConstRefVector&lt;MSSpectrum&lt;PeakType&gt;</a> &gt; c_sorted_spec(spec.begin(), spec.end());</div>
<div class="line"><a name="l00159"></a><span class="lineno">  159</span>&#160;      <span class="comment">//Sort in ascending order according to the intensities present in the transform</span></div>
<div class="line"><a name="l00160"></a><span class="lineno">  160</span>&#160;      c_sorted_spec.<a class="code" href="classOpenMS_1_1ConstRefVector.html#a86f7b200260209865e730a2e4fcaa628">sortByPosition</a>();</div>
<div class="line"><a name="l00161"></a><span class="lineno">  161</span>&#160;</div>
<div class="line"><a name="l00162"></a><span class="lineno">  162</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00163"></a><span class="lineno">  163</span>&#160;<span class="preprocessor"></span>      std::ofstream ofilex(<span class="stringliteral">&quot;spacings.trans&quot;</span>);</div>
<div class="line"><a name="l00164"></a><span class="lineno">  164</span>&#160;      <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> j = 0; j &lt; spec.size() - 1; ++j)</div>
<div class="line"><a name="l00165"></a><span class="lineno">  165</span>&#160;      {</div>
<div class="line"><a name="l00166"></a><span class="lineno">  166</span>&#160;        ofilex &lt;&lt; ::std::setprecision(12) &lt;&lt; std::fixed &lt;&lt; spec[j].getMZ() &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; spec[j].getIntensity() &lt;&lt; std::endl;</div>
<div class="line"><a name="l00167"></a><span class="lineno">  167</span>&#160;      }</div>
<div class="line"><a name="l00168"></a><span class="lineno">  168</span>&#160;      ofilex.close();</div>
<div class="line"><a name="l00169"></a><span class="lineno">  169</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00170"></a><span class="lineno">  170</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00171"></a><span class="lineno">  171</span>&#160;      <a class="code" href="classunsigned_01int.html">UInt</a> pos = 0;</div>
<div class="line"><a name="l00172"></a><span class="lineno">  172</span>&#160;      <span class="keywordflow">while</span> (c_sorted_spec[pos].getIntensity() &lt;= 0)</div>
<div class="line"><a name="l00173"></a><span class="lineno">  173</span>&#160;      {</div>
<div class="line"><a name="l00174"></a><span class="lineno">  174</span>&#160;        <span class="keywordflow">if</span> (++pos &gt;= c_sorted_spec.size())</div>
<div class="line"><a name="l00175"></a><span class="lineno">  175</span>&#160;        {</div>
<div class="line"><a name="l00176"></a><span class="lineno">  176</span>&#160;          std::cout &lt;&lt; <span class="stringliteral">&quot;Detected empty scan or a scan that cannot be interpolated with zeros in HR mode. &quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00177"></a><span class="lineno">  177</span>&#160;          std::cout &lt;&lt; <span class="stringliteral">&quot;Please check scan # &quot;</span> &lt;&lt; i &lt;&lt; <span class="stringliteral">&quot; of your data set.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00178"></a><span class="lineno">  178</span>&#160;          exit(-1);</div>
<div class="line"><a name="l00179"></a><span class="lineno">  179</span>&#160;        }</div>
<div class="line"><a name="l00180"></a><span class="lineno">  180</span>&#160;      }</div>
<div class="line"><a name="l00181"></a><span class="lineno">  181</span>&#160;      <a class="code" href="classdouble.html">DoubleReal</a> bound = -1 * c_sorted_spec[pos].getMZ();</div>
<div class="line"><a name="l00182"></a><span class="lineno">  182</span>&#160;</div>
<div class="line"><a name="l00183"></a><span class="lineno">  183</span>&#160;      <span class="keywordflow">if</span> (bound &gt; (1. / <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>) / 2.)</div>
<div class="line"><a name="l00184"></a><span class="lineno">  184</span>&#160;      {</div>
<div class="line"><a name="l00185"></a><span class="lineno">  185</span>&#160;        <span class="comment">//that might be case for simulated spectra,</span></div>
<div class="line"><a name="l00186"></a><span class="lineno">  186</span>&#160;        <span class="comment">//which might show a very artificial spacing</span></div>
<div class="line"><a name="l00187"></a><span class="lineno">  187</span>&#160;        bound = (1. / <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>) / 2. / 4.;</div>
<div class="line"><a name="l00188"></a><span class="lineno">  188</span>&#160;      }</div>
<div class="line"><a name="l00189"></a><span class="lineno">  189</span>&#160;</div>
<div class="line"><a name="l00190"></a><span class="lineno">  190</span>&#160;      <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> * new_spec = <span class="keyword">new</span> <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a>;</div>
<div class="line"><a name="l00191"></a><span class="lineno">  191</span>&#160;      new_spec-&gt;reserve(200000);</div>
<div class="line"><a name="l00192"></a><span class="lineno">  192</span>&#160;      new_spec-&gt;<a class="code" href="classOpenMS_1_1MSSpectrum.html#aac8c50f318154e9e5b7b01aee806e17f">setRT</a>(((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]).getRT());</div>
<div class="line"><a name="l00193"></a><span class="lineno">  193</span>&#160;      PeakType p; p.<a class="code" href="classOpenMS_1_1Peak2D.html#a2694f0775c46d9076355cb85d9815425">setMZ</a>(specr[0].getMZ()); p.<a class="code" href="classOpenMS_1_1Peak2D.html#ab875c2479c6cd2a0189e4684bfa4f97d">setIntensity</a>(specr[0].getIntensity());</div>
<div class="line"><a name="l00194"></a><span class="lineno">  194</span>&#160;      new_spec-&gt;push_back(p);</div>
<div class="line"><a name="l00195"></a><span class="lineno">  195</span>&#160;</div>
<div class="line"><a name="l00196"></a><span class="lineno">  196</span>&#160;      <a class="code" href="classunsigned_01int.html">UInt</a> count;</div>
<div class="line"><a name="l00197"></a><span class="lineno">  197</span>&#160;      <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> j = 0; j &lt; spec.size() - 1; ++j)</div>
<div class="line"><a name="l00198"></a><span class="lineno">  198</span>&#160;      {</div>
<div class="line"><a name="l00199"></a><span class="lineno">  199</span>&#160;        count = 0;</div>
<div class="line"><a name="l00200"></a><span class="lineno">  200</span>&#160;        <span class="keywordflow">while</span> (-spec[j].getMZ() - count * bound &gt; bound)</div>
<div class="line"><a name="l00201"></a><span class="lineno">  201</span>&#160;        {</div>
<div class="line"><a name="l00202"></a><span class="lineno">  202</span>&#160;          ++count;</div>
<div class="line"><a name="l00203"></a><span class="lineno">  203</span>&#160;          p.<a class="code" href="classOpenMS_1_1Peak2D.html#a2694f0775c46d9076355cb85d9815425">setMZ</a>(specr[j].getMZ() + count * bound); p.<a class="code" href="classOpenMS_1_1Peak2D.html#ab875c2479c6cd2a0189e4684bfa4f97d">setIntensity</a>(0);</div>
<div class="line"><a name="l00204"></a><span class="lineno">  204</span>&#160;          new_spec-&gt;push_back(p);</div>
<div class="line"><a name="l00205"></a><span class="lineno">  205</span>&#160;        }</div>
<div class="line"><a name="l00206"></a><span class="lineno">  206</span>&#160;        p.<a class="code" href="classOpenMS_1_1Peak2D.html#a2694f0775c46d9076355cb85d9815425">setMZ</a>(specr[j + 1].getMZ()); p.<a class="code" href="classOpenMS_1_1Peak2D.html#ab875c2479c6cd2a0189e4684bfa4f97d">setIntensity</a>(specr[j + 1].getIntensity());</div>
<div class="line"><a name="l00207"></a><span class="lineno">  207</span>&#160;        new_spec-&gt;push_back(p);</div>
<div class="line"><a name="l00208"></a><span class="lineno">  208</span>&#160;      }</div>
<div class="line"><a name="l00209"></a><span class="lineno">  209</span>&#160;</div>
<div class="line"><a name="l00210"></a><span class="lineno">  210</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00211"></a><span class="lineno">  211</span>&#160;<span class="preprocessor"></span>      std::ofstream ofiley(<span class="stringliteral">&quot;new_spec.trans&quot;</span>);</div>
<div class="line"><a name="l00212"></a><span class="lineno">  212</span>&#160;      <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> j = 0; j &lt; new_spec-&gt;size(); ++j)</div>
<div class="line"><a name="l00213"></a><span class="lineno">  213</span>&#160;      {</div>
<div class="line"><a name="l00214"></a><span class="lineno">  214</span>&#160;        ofiley &lt;&lt; ::std::setprecision(12) &lt;&lt; std::fixed &lt;&lt; (*new_spec)[j].getMZ() &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; (*new_spec)[j].getIntensity() &lt;&lt; std::endl;</div>
<div class="line"><a name="l00215"></a><span class="lineno">  215</span>&#160;      }</div>
<div class="line"><a name="l00216"></a><span class="lineno">  216</span>&#160;      ofiley.close();</div>
<div class="line"><a name="l00217"></a><span class="lineno">  217</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00218"></a><span class="lineno">  218</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00219"></a><span class="lineno">  219</span>&#160;      <span class="keywordflow">return</span> new_spec;</div>
<div class="line"><a name="l00220"></a><span class="lineno">  220</span>&#160;    }</div>
<div class="line"><a name="l00221"></a><span class="lineno">  221</span>&#160;</div>
<div class="line"><a name="l00223"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a13a43e6d814de94978c515cb084873b1">  223</a></span>&#160;    <span class="keywordtype">void</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a13a43e6d814de94978c515cb084873b1">run</a>()</div>
<div class="line"><a name="l00224"></a><span class="lineno">  224</span>&#160;    {</div>
<div class="line"><a name="l00225"></a><span class="lineno">  225</span>&#160;      <a class="code" href="classdouble.html">DoubleReal</a> max_mz = this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>-&gt;<a class="code" href="classOpenMS_1_1RangeManager.html#ab54df5a3894df5cebc88022e8684ff65">getMax</a>()[1];</div>
<div class="line"><a name="l00226"></a><span class="lineno">  226</span>&#160;      <a class="code" href="classdouble.html">DoubleReal</a> min_mz = this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>-&gt;<a class="code" href="classOpenMS_1_1RangeManager.html#ad7e9497afbc70b1bd40dba2874802954">getMin</a>()[1];</div>
<div class="line"><a name="l00227"></a><span class="lineno">  227</span>&#160;</div>
<div class="line"><a name="l00228"></a><span class="lineno">  228</span>&#160;      <a class="code" href="group__Concept.html#gaf9ecec2d692138fab9167164a457cbd4">Size</a> max_size = 0;</div>
<div class="line"><a name="l00229"></a><span class="lineno">  229</span>&#160;<span class="preprocessor">#ifdef OPENMS_HAS_CUDA</span></div>
<div class="line"><a name="l00230"></a><span class="lineno">  230</span>&#160;<span class="preprocessor"></span>      <span class="keywordflow">if</span> (<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae8f10b1319ef92b7f0ed3a31aaab93a9">use_cuda_</a>)               <span class="comment">//some preprocessing necessary for the GPU computation</span></div>
<div class="line"><a name="l00231"></a><span class="lineno">  231</span>&#160;      {</div>
<div class="line"><a name="l00232"></a><span class="lineno">  232</span>&#160;        <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> i = 0; i &lt; this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>-&gt;<a class="code" href="classOpenMS_1_1MSExperiment.html#a9d78a687cf2a391198bb3cbc08bc06cb">size</a>(); ++i)</div>
<div class="line"><a name="l00233"></a><span class="lineno">  233</span>&#160;        {</div>
<div class="line"><a name="l00234"></a><span class="lineno">  234</span>&#160;          max_size = std::max(max_size, (*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i].size());</div>
<div class="line"><a name="l00235"></a><span class="lineno">  235</span>&#160;        }</div>
<div class="line"><a name="l00236"></a><span class="lineno">  236</span>&#160;      }</div>
<div class="line"><a name="l00237"></a><span class="lineno">  237</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00238"></a><span class="lineno">  238</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00239"></a><span class="lineno">  239</span>&#160;      <span class="comment">//Check for useless RT_votes_cutoff_ parameter</span></div>
<div class="line"><a name="l00240"></a><span class="lineno">  240</span>&#160;      <span class="keywordflow">if</span> (<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3fd609fd7b023618f7f2c5c64e8ed803">RT_votes_cutoff_</a> &gt; this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>-&gt;<a class="code" href="classOpenMS_1_1MSExperiment.html#a9d78a687cf2a391198bb3cbc08bc06cb">size</a>())</div>
<div class="line"><a name="l00241"></a><span class="lineno">  241</span>&#160;      {</div>
<div class="line"><a name="l00242"></a><span class="lineno">  242</span>&#160;        <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">real_RT_votes_cutoff_</a> = 0;</div>
<div class="line"><a name="l00243"></a><span class="lineno">  243</span>&#160;      }</div>
<div class="line"><a name="l00244"></a><span class="lineno">  244</span>&#160;      <span class="keywordflow">else</span></div>
<div class="line"><a name="l00245"></a><span class="lineno">  245</span>&#160;      {</div>
<div class="line"><a name="l00246"></a><span class="lineno">  246</span>&#160;        <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">real_RT_votes_cutoff_</a> = <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3fd609fd7b023618f7f2c5c64e8ed803">RT_votes_cutoff_</a>;</div>
<div class="line"><a name="l00247"></a><span class="lineno">  247</span>&#160;      }</div>
<div class="line"><a name="l00248"></a><span class="lineno">  248</span>&#160;</div>
<div class="line"><a name="l00249"></a><span class="lineno">  249</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#acc3538c5284777d8702ccaefeb61e74c">setLogType</a>(<a class="code" href="classOpenMS_1_1ProgressLogger.html#af67907baa897e9fb84df0cb89795b87ca3ab34dd50405af2d5a62627d572f7860">ProgressLogger::CMD</a>);</div>
<div class="line"><a name="l00250"></a><span class="lineno">  250</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a> = 0;</div>
<div class="line"><a name="l00251"></a><span class="lineno">  251</span>&#160;      this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#af1c45ecd71b5041b70319249e8e73591">startProgress</a>(0, 2 * this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>-&gt;<a class="code" href="classOpenMS_1_1MSExperiment.html#a9d78a687cf2a391198bb3cbc08bc06cb">size</a>() * <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>, <span class="stringliteral">&quot;analyzing spectra&quot;</span>);</div>
<div class="line"><a name="l00252"></a><span class="lineno">  252</span>&#160;</div>
<div class="line"><a name="l00253"></a><span class="lineno">  253</span>&#160;<span class="preprocessor">#if defined(OPENMS_HAS_TBB) &amp;&amp; defined(OPENMS_HAS_CUDA)</span></div>
<div class="line"><a name="l00254"></a><span class="lineno">  254</span>&#160;<span class="preprocessor"></span>      <span class="keywordflow">if</span> (<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a>)</div>
<div class="line"><a name="l00255"></a><span class="lineno">  255</span>&#160;      {</div>
<div class="line"><a name="l00256"></a><span class="lineno">  256</span>&#160;        <a class="code" href="classunsigned_01int.html">UInt</a> num_gpus = this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>.size();</div>
<div class="line"><a name="l00257"></a><span class="lineno">  257</span>&#160;        tbb::task_scheduler_init init(num_gpus);</div>
<div class="line"><a name="l00258"></a><span class="lineno">  258</span>&#160;        std::vector&lt;IsotopeWaveletTransform&lt;PeakType&gt; *&gt; iwts(num_gpus);</div>
<div class="line"><a name="l00259"></a><span class="lineno">  259</span>&#160;</div>
<div class="line"><a name="l00260"></a><span class="lineno">  260</span>&#160;        <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> t = 0; t &lt; num_gpus; ++t)</div>
<div class="line"><a name="l00261"></a><span class="lineno">  261</span>&#160;        {</div>
<div class="line"><a name="l00262"></a><span class="lineno">  262</span>&#160;          iwts[t] = <span class="keyword">new</span> <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html">IsotopeWaveletTransform&lt;PeakType&gt;</a>(min_mz, max_mz, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>, max_size, <span class="keyword">true</span>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af082d2d0e78145cb7e949f3e6a4d92a7">hr_data_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a17a0a86ea1bf9a231c53429ea99e086b">intensity_type_</a>);</div>
<div class="line"><a name="l00263"></a><span class="lineno">  263</span>&#160;        }</div>
<div class="line"><a name="l00264"></a><span class="lineno">  264</span>&#160;</div>
<div class="line"><a name="l00265"></a><span class="lineno">  265</span>&#160;        <span class="keyword">static</span> tbb::affinity_partitioner ap;</div>
<div class="line"><a name="l00266"></a><span class="lineno">  266</span>&#160;        <span class="comment">//The parallel execution over all available GPU devices</span></div>
<div class="line"><a name="l00267"></a><span class="lineno">  267</span>&#160;        tbb::parallel_for(tbb::blocked_range&lt;size_t&gt;(0, num_gpus, 1), <a class="code" href="classOpenMS_1_1IsotopeWaveletParallelFor.html">IsotopeWaveletParallelFor&lt;PeakType, FeatureType&gt;</a>(iwts, <span class="keyword">this</span>), ap);</div>
<div class="line"><a name="l00268"></a><span class="lineno">  268</span>&#160;</div>
<div class="line"><a name="l00269"></a><span class="lineno">  269</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00270"></a><span class="lineno">  270</span>&#160;<span class="preprocessor"></span>        std::cout &lt;&lt; <span class="stringliteral">&quot;Merging.&quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00271"></a><span class="lineno">  271</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00272"></a><span class="lineno">  272</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00273"></a><span class="lineno">  273</span>&#160;        <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> t = 1; t &lt; num_gpus; ++t)</div>
<div class="line"><a name="l00274"></a><span class="lineno">  274</span>&#160;        {</div>
<div class="line"><a name="l00275"></a><span class="lineno">  275</span>&#160;          iwts[0]-&gt;mergeFeatures(iwts[t], <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a0864e2810fe75ef5519f320c957efb1b">RT_interleave_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3fd609fd7b023618f7f2c5c64e8ed803">RT_votes_cutoff_</a>);</div>
<div class="line"><a name="l00276"></a><span class="lineno">  276</span>&#160;        }</div>
<div class="line"><a name="l00277"></a><span class="lineno">  277</span>&#160;</div>
<div class="line"><a name="l00278"></a><span class="lineno">  278</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00279"></a><span class="lineno">  279</span>&#160;<span class="preprocessor"></span>        std::cout &lt;&lt; <span class="stringliteral">&quot;Final mapping.&quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00280"></a><span class="lineno">  280</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00281"></a><span class="lineno">  281</span>&#160;<span class="preprocessor"></span>        *this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a5f09052343ef99616ad653897841ce3e">features_</a> = iwts[0]-&gt;mapSeeds2Features(*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">real_RT_votes_cutoff_</a>);</div>
<div class="line"><a name="l00282"></a><span class="lineno">  282</span>&#160;</div>
<div class="line"><a name="l00283"></a><span class="lineno">  283</span>&#160;        <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> t = 0; t &lt; num_gpus; ++t)</div>
<div class="line"><a name="l00284"></a><span class="lineno">  284</span>&#160;        {</div>
<div class="line"><a name="l00285"></a><span class="lineno">  285</span>&#160;          <span class="keyword">delete</span> (iwts[t]);</div>
<div class="line"><a name="l00286"></a><span class="lineno">  286</span>&#160;        }</div>
<div class="line"><a name="l00287"></a><span class="lineno">  287</span>&#160;      }</div>
<div class="line"><a name="l00288"></a><span class="lineno">  288</span>&#160;<span class="preprocessor">#else</span></div>
<div class="line"><a name="l00289"></a><span class="lineno">  289</span>&#160;<span class="preprocessor"></span>      <span class="keywordflow">if</span> (<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a>)</div>
<div class="line"><a name="l00290"></a><span class="lineno">  290</span>&#160;      {</div>
<div class="line"><a name="l00291"></a><span class="lineno">  291</span>&#160;        std::cerr &lt;&lt; <span class="stringliteral">&quot;Error: You requested computation via TBB, but OpenMS has not been configured for TBB usage.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00292"></a><span class="lineno">  292</span>&#160;        std::cerr &lt;&lt; <span class="stringliteral">&quot;Error: You need to rebuild OpenMS using the configure flag \&quot;--enable-tbb-release\&quot; or \&quot;--enable-tbb-debug\&quot;.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00293"></a><span class="lineno">  293</span>&#160;        std::cerr &lt;&lt; <span class="stringliteral">&quot;Error: Please note that the multithreaded FeatureFinder needs necessarily the CUDA library, which must be enabled with \&quot;--enable-cuda\&quot;.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00294"></a><span class="lineno">  294</span>&#160;      }</div>
<div class="line"><a name="l00295"></a><span class="lineno">  295</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00296"></a><span class="lineno">  296</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00297"></a><span class="lineno">  297</span>&#160;      <span class="keywordflow">if</span> (!<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a>)</div>
<div class="line"><a name="l00298"></a><span class="lineno">  298</span>&#160;      {</div>
<div class="line"><a name="l00299"></a><span class="lineno">  299</span>&#160;        <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html">IsotopeWaveletTransform&lt;PeakType&gt;</a> * iwt = <span class="keyword">new</span> <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html">IsotopeWaveletTransform&lt;PeakType&gt;</a>(min_mz, max_mz, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>, max_size, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae8f10b1319ef92b7f0ed3a31aaab93a9">use_cuda_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af082d2d0e78145cb7e949f3e6a4d92a7">hr_data_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a17a0a86ea1bf9a231c53429ea99e086b">intensity_type_</a>);</div>
<div class="line"><a name="l00300"></a><span class="lineno">  300</span>&#160;<span class="preprocessor">#ifdef OPENMS_HAS_CUDA</span></div>
<div class="line"><a name="l00301"></a><span class="lineno">  301</span>&#160;<span class="preprocessor"></span>        <span class="keywordflow">if</span> (use_cuda_)</div>
<div class="line"><a name="l00302"></a><span class="lineno">  302</span>&#160;        {</div>
<div class="line"><a name="l00303"></a><span class="lineno">  303</span>&#160;          cudaSetDevice(<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>[0]);</div>
<div class="line"><a name="l00304"></a><span class="lineno">  304</span>&#160;          std::cout &lt;&lt; <span class="stringliteral">&quot;Using device with ID: &quot;</span> &lt;&lt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>[0] &lt;&lt; std::endl;</div>
<div class="line"><a name="l00305"></a><span class="lineno">  305</span>&#160;          cudaDeviceProp props;</div>
<div class="line"><a name="l00306"></a><span class="lineno">  306</span>&#160;          cudaGetDeviceProperties(&amp;props, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>[0]);</div>
<div class="line"><a name="l00307"></a><span class="lineno">  307</span>&#160;          std::cout &lt;&lt; <span class="stringliteral">&quot;This device is named: &quot;</span> &lt;&lt; props.name &lt;&lt; std::endl;</div>
<div class="line"><a name="l00308"></a><span class="lineno">  308</span>&#160;        }</div>
<div class="line"><a name="l00309"></a><span class="lineno">  309</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00310"></a><span class="lineno">  310</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00311"></a><span class="lineno">  311</span>&#160;        <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> i = 0; i &lt; this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>-&gt;<a class="code" href="classOpenMS_1_1MSExperiment.html#a9d78a687cf2a391198bb3cbc08bc06cb">size</a>(); ++i)</div>
<div class="line"><a name="l00312"></a><span class="lineno">  312</span>&#160;        {</div>
<div class="line"><a name="l00313"></a><span class="lineno">  313</span>&#160;          <span class="keyword">const</span> <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> &amp; c_ref((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]);</div>
<div class="line"><a name="l00314"></a><span class="lineno">  314</span>&#160;</div>
<div class="line"><a name="l00315"></a><span class="lineno">  315</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00316"></a><span class="lineno">  316</span>&#160;<span class="preprocessor"></span>          std::cout &lt;&lt; ::std::fixed &lt;&lt; ::std::setprecision(6) &lt;&lt; <span class="stringliteral">&quot;Spectrum &quot;</span> &lt;&lt; i + 1 &lt;&lt; <span class="stringliteral">&quot; (&quot;</span> &lt;&lt; (*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i].getRT() &lt;&lt; <span class="stringliteral">&quot;) of &quot;</span> &lt;&lt; this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>-&gt;<a class="code" href="classOpenMS_1_1MSExperiment.html#a9d78a687cf2a391198bb3cbc08bc06cb">size</a>() &lt;&lt; <span class="stringliteral">&quot; ... &quot;</span>;</div>
<div class="line"><a name="l00317"></a><span class="lineno">  317</span>&#160;          std::cout.flush();</div>
<div class="line"><a name="l00318"></a><span class="lineno">  318</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00319"></a><span class="lineno">  319</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00320"></a><span class="lineno">  320</span>&#160;          <span class="keywordflow">if</span> (c_ref.size() &lt;= 1)               <span class="comment">//unable to do transform anything</span></div>
<div class="line"><a name="l00321"></a><span class="lineno">  321</span>&#160;          {</div>
<div class="line"><a name="l00322"></a><span class="lineno">  322</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00323"></a><span class="lineno">  323</span>&#160;<span class="preprocessor"></span>            std::cout &lt;&lt; <span class="stringliteral">&quot;scan empty or consisting of a single data point. Skipping.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00324"></a><span class="lineno">  324</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00325"></a><span class="lineno">  325</span>&#160;<span class="preprocessor"></span>            this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a> += 2);</div>
<div class="line"><a name="l00326"></a><span class="lineno">  326</span>&#160;            <span class="keywordflow">continue</span>;</div>
<div class="line"><a name="l00327"></a><span class="lineno">  327</span>&#160;          }</div>
<div class="line"><a name="l00328"></a><span class="lineno">  328</span>&#160;</div>
<div class="line"><a name="l00329"></a><span class="lineno">  329</span>&#160;          <span class="keywordflow">if</span> (!use_cuda_)</div>
<div class="line"><a name="l00330"></a><span class="lineno">  330</span>&#160;          {</div>
<div class="line"><a name="l00331"></a><span class="lineno">  331</span>&#160;            <span class="keywordflow">if</span> (!hr_data_)                 <span class="comment">//Lowres data</span></div>
<div class="line"><a name="l00332"></a><span class="lineno">  332</span>&#160;            {</div>
<div class="line"><a name="l00333"></a><span class="lineno">  333</span>&#160;              iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#ab99b362c90b6915c337cc919b73b599f">initializeScan</a>((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]);</div>
<div class="line"><a name="l00334"></a><span class="lineno">  334</span>&#160;              <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> &lt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>; ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>)</div>
<div class="line"><a name="l00335"></a><span class="lineno">  335</span>&#160;              {</div>
<div class="line"><a name="l00336"></a><span class="lineno">  336</span>&#160;                <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> c_trans(c_ref);</div>
<div class="line"><a name="l00337"></a><span class="lineno">  337</span>&#160;</div>
<div class="line"><a name="l00338"></a><span class="lineno">  338</span>&#160;                iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#a54c204f5b2d6a44874df21661e992224">getTransform</a>(c_trans, c_ref, <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>);</div>
<div class="line"><a name="l00339"></a><span class="lineno">  339</span>&#160;</div>
<div class="line"><a name="l00340"></a><span class="lineno">  340</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00341"></a><span class="lineno">  341</span>&#160;<span class="preprocessor"></span>                std::stringstream stream;</div>
<div class="line"><a name="l00342"></a><span class="lineno">  342</span>&#160;                stream &lt;&lt; <span class="stringliteral">&quot;cpu_lowres_&quot;</span> &lt;&lt; c_ref.<a class="code" href="classOpenMS_1_1MSSpectrum.html#a3da529bd3240fa0d7148484bbef0b9d7">getRT</a>() &lt;&lt; <span class="stringliteral">&quot;_&quot;</span> &lt;&lt; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> + 1 &lt;&lt; <span class="stringliteral">&quot;.trans\0&quot;</span>;</div>
<div class="line"><a name="l00343"></a><span class="lineno">  343</span>&#160;                std::ofstream ofile(stream.str().c_str());</div>
<div class="line"><a name="l00344"></a><span class="lineno">  344</span>&#160;                <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> &lt; c_ref.size(); ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>)</div>
<div class="line"><a name="l00345"></a><span class="lineno">  345</span>&#160;                {</div>
<div class="line"><a name="l00346"></a><span class="lineno">  346</span>&#160;                  ofile &lt;&lt; ::std::setprecision(8) &lt;&lt; std::fixed &lt;&lt; c_trans[<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>].getMZ() &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; c_trans[<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>].getIntensity() &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; c_ref[<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>].getIntensity() &lt;&lt; std::endl;</div>
<div class="line"><a name="l00347"></a><span class="lineno">  347</span>&#160;                }</div>
<div class="line"><a name="l00348"></a><span class="lineno">  348</span>&#160;                ofile.close();</div>
<div class="line"><a name="l00349"></a><span class="lineno">  349</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00350"></a><span class="lineno">  350</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00351"></a><span class="lineno">  351</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00352"></a><span class="lineno">  352</span>&#160;<span class="preprocessor"></span>                std::cout &lt;&lt; <span class="stringliteral">&quot;transform O.K. ... &quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00353"></a><span class="lineno">  353</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00354"></a><span class="lineno">  354</span>&#160;<span class="preprocessor"></span>                this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00355"></a><span class="lineno">  355</span>&#160;</div>
<div class="line"><a name="l00356"></a><span class="lineno">  356</span>&#160;                iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#ad7b38b52b1b16ca069e80ff8b8618295">identifyCharge</a>(c_trans, c_ref, i, <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">intensity_threshold_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ac0914e52b60b67388b6ca7648922b447">check_PPMs_</a>);</div>
<div class="line"><a name="l00357"></a><span class="lineno">  357</span>&#160;</div>
<div class="line"><a name="l00358"></a><span class="lineno">  358</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00359"></a><span class="lineno">  359</span>&#160;<span class="preprocessor"></span>                std::cout &lt;&lt; <span class="stringliteral">&quot;charge recognition O.K. ... &quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00360"></a><span class="lineno">  360</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00361"></a><span class="lineno">  361</span>&#160;<span class="preprocessor"></span>                this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00362"></a><span class="lineno">  362</span>&#160;              }</div>
<div class="line"><a name="l00363"></a><span class="lineno">  363</span>&#160;            }</div>
<div class="line"><a name="l00364"></a><span class="lineno">  364</span>&#160;            <span class="keywordflow">else</span>                 <span class="comment">//Highres data</span></div>
<div class="line"><a name="l00365"></a><span class="lineno">  365</span>&#160;            {</div>
<div class="line"><a name="l00366"></a><span class="lineno">  366</span>&#160;              <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> * new_spec(<a class="code" href="IsotopeWaveletParallelFor_8h.html#a070d2ce7b6bb7e5c05602aa8c308d0c4">NULL</a>);</div>
<div class="line"><a name="l00367"></a><span class="lineno">  367</span>&#160;              <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> &lt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>; ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>)</div>
<div class="line"><a name="l00368"></a><span class="lineno">  368</span>&#160;              {</div>
<div class="line"><a name="l00369"></a><span class="lineno">  369</span>&#160;                new_spec = <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a80a937e9a0dd8e9426bd2e0051ecaa33">createHRData</a>(i);</div>
<div class="line"><a name="l00370"></a><span class="lineno">  370</span>&#160;                iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#ab99b362c90b6915c337cc919b73b599f">initializeScan</a>(*new_spec, <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>);</div>
<div class="line"><a name="l00371"></a><span class="lineno">  371</span>&#160;                <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> c_trans(*new_spec);</div>
<div class="line"><a name="l00372"></a><span class="lineno">  372</span>&#160;</div>
<div class="line"><a name="l00373"></a><span class="lineno">  373</span>&#160;                iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#ad9ced5a5293256ab54096986d28d693f">getTransformHighRes</a>(c_trans, *new_spec, <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>);</div>
<div class="line"><a name="l00374"></a><span class="lineno">  374</span>&#160;</div>
<div class="line"><a name="l00375"></a><span class="lineno">  375</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00376"></a><span class="lineno">  376</span>&#160;<span class="preprocessor"></span>                std::stringstream stream;</div>
<div class="line"><a name="l00377"></a><span class="lineno">  377</span>&#160;                stream &lt;&lt; <span class="stringliteral">&quot;cpu_highres_&quot;</span> &lt;&lt; new_spec-&gt;<a class="code" href="classOpenMS_1_1MSSpectrum.html#a3da529bd3240fa0d7148484bbef0b9d7">getRT</a>() &lt;&lt; <span class="stringliteral">&quot;_&quot;</span> &lt;&lt; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> + 1 &lt;&lt; <span class="stringliteral">&quot;.trans\0&quot;</span>;</div>
<div class="line"><a name="l00378"></a><span class="lineno">  378</span>&#160;                std::ofstream ofile(stream.str().c_str());</div>
<div class="line"><a name="l00379"></a><span class="lineno">  379</span>&#160;                <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> &lt; new_spec-&gt;size(); ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>)</div>
<div class="line"><a name="l00380"></a><span class="lineno">  380</span>&#160;                {</div>
<div class="line"><a name="l00381"></a><span class="lineno">  381</span>&#160;                  ofile &lt;&lt; ::std::setprecision(8) &lt;&lt; std::fixed &lt;&lt; c_trans[<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>].getMZ() &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; c_trans[<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>].getIntensity() &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; (*new_spec)[<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>].getIntensity() &lt;&lt; std::endl;</div>
<div class="line"><a name="l00382"></a><span class="lineno">  382</span>&#160;                }</div>
<div class="line"><a name="l00383"></a><span class="lineno">  383</span>&#160;                ofile.close();</div>
<div class="line"><a name="l00384"></a><span class="lineno">  384</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00385"></a><span class="lineno">  385</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00386"></a><span class="lineno">  386</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00387"></a><span class="lineno">  387</span>&#160;<span class="preprocessor"></span>                std::cout &lt;&lt; <span class="stringliteral">&quot;transform O.K. ... &quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00388"></a><span class="lineno">  388</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00389"></a><span class="lineno">  389</span>&#160;<span class="preprocessor"></span>                this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00390"></a><span class="lineno">  390</span>&#160;</div>
<div class="line"><a name="l00391"></a><span class="lineno">  391</span>&#160;                iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#ad7b38b52b1b16ca069e80ff8b8618295">identifyCharge</a>(c_trans, *new_spec, i, <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">intensity_threshold_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ac0914e52b60b67388b6ca7648922b447">check_PPMs_</a>);</div>
<div class="line"><a name="l00392"></a><span class="lineno">  392</span>&#160;</div>
<div class="line"><a name="l00393"></a><span class="lineno">  393</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00394"></a><span class="lineno">  394</span>&#160;<span class="preprocessor"></span>                std::cout &lt;&lt; <span class="stringliteral">&quot;charge recognition O.K. ... &quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00395"></a><span class="lineno">  395</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00396"></a><span class="lineno">  396</span>&#160;<span class="preprocessor"></span>                this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00397"></a><span class="lineno">  397</span>&#160;</div>
<div class="line"><a name="l00398"></a><span class="lineno">  398</span>&#160;                <span class="keyword">delete</span> (new_spec); new_spec = <a class="code" href="IsotopeWaveletParallelFor_8h.html#a070d2ce7b6bb7e5c05602aa8c308d0c4">NULL</a>;</div>
<div class="line"><a name="l00399"></a><span class="lineno">  399</span>&#160;              }</div>
<div class="line"><a name="l00400"></a><span class="lineno">  400</span>&#160;            }</div>
<div class="line"><a name="l00401"></a><span class="lineno">  401</span>&#160;          }</div>
<div class="line"><a name="l00402"></a><span class="lineno">  402</span>&#160;          <span class="keywordflow">else</span>               <span class="comment">//use CUDA but not TBB</span></div>
<div class="line"><a name="l00403"></a><span class="lineno">  403</span>&#160;          {</div>
<div class="line"><a name="l00404"></a><span class="lineno">  404</span>&#160;<span class="preprocessor">#ifdef OPENMS_HAS_CUDA</span></div>
<div class="line"><a name="l00405"></a><span class="lineno">  405</span>&#160;<span class="preprocessor"></span>            <span class="keywordtype">bool</span> success = <span class="keyword">true</span>;</div>
<div class="line"><a name="l00406"></a><span class="lineno">  406</span>&#160;            <span class="keyword">typename</span> <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html">IsotopeWaveletTransform&lt;PeakType&gt;::TransSpectrum</a> * c_trans(<a class="code" href="IsotopeWaveletParallelFor_8h.html#a070d2ce7b6bb7e5c05602aa8c308d0c4">NULL</a>); <a class="code" href="classOpenMS_1_1MSSpectrum.html">MSSpectrum&lt;PeakType&gt;</a> * new_spec(<a class="code" href="IsotopeWaveletParallelFor_8h.html#a070d2ce7b6bb7e5c05602aa8c308d0c4">NULL</a>);</div>
<div class="line"><a name="l00407"></a><span class="lineno">  407</span>&#160;            <span class="keywordflow">if</span> (!hr_data_)                     <span class="comment">//LowRes data</span></div>
<div class="line"><a name="l00408"></a><span class="lineno">  408</span>&#160;            {</div>
<div class="line"><a name="l00409"></a><span class="lineno">  409</span>&#160;              c_trans = <span class="keyword">new</span> <span class="keyword">typename</span> <a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html">IsotopeWaveletTransform&lt;PeakType&gt;::TransSpectrum</a>(&amp;(*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]);</div>
<div class="line"><a name="l00410"></a><span class="lineno">  410</span>&#160;              success = iwt-&gt;initializeScanCuda((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]) == <a class="code" href="namespaceOpenMS_1_1Constants.html#a53aae8780a5fb5cca0b69ece3f1c226c">Constants::CUDA_INIT_SUCCESS</a>;</div>
<div class="line"><a name="l00411"></a><span class="lineno">  411</span>&#160;</div>
<div class="line"><a name="l00412"></a><span class="lineno">  412</span>&#160;              <span class="keywordflow">if</span> (success)</div>
<div class="line"><a name="l00413"></a><span class="lineno">  413</span>&#160;              {</div>
<div class="line"><a name="l00414"></a><span class="lineno">  414</span>&#160;                <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> &lt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>; ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>)</div>
<div class="line"><a name="l00415"></a><span class="lineno">  415</span>&#160;                {</div>
<div class="line"><a name="l00416"></a><span class="lineno">  416</span>&#160;                  iwt-&gt;getTransformCuda(*c_trans, <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>);</div>
<div class="line"><a name="l00417"></a><span class="lineno">  417</span>&#160;</div>
<div class="line"><a name="l00418"></a><span class="lineno">  418</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00419"></a><span class="lineno">  419</span>&#160;<span class="preprocessor"></span>                  std::stringstream stream;</div>
<div class="line"><a name="l00420"></a><span class="lineno">  420</span>&#160;                  stream &lt;&lt; <span class="stringliteral">&quot;gpu_lowres_&quot;</span> &lt;&lt; ((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]).getRT() &lt;&lt; <span class="stringliteral">&quot;_&quot;</span> &lt;&lt; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> + 1 &lt;&lt; <span class="stringliteral">&quot;.trans\0&quot;</span>;</div>
<div class="line"><a name="l00421"></a><span class="lineno">  421</span>&#160;                  std::ofstream ofile(stream.str().c_str());</div>
<div class="line"><a name="l00422"></a><span class="lineno">  422</span>&#160;                  <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> &lt; c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a9d78a687cf2a391198bb3cbc08bc06cb">size</a>(); ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>)</div>
<div class="line"><a name="l00423"></a><span class="lineno">  423</span>&#160;                  {</div>
<div class="line"><a name="l00424"></a><span class="lineno">  424</span>&#160;                    ofile &lt;&lt; ::std::setprecision(8) &lt;&lt; std::fixed &lt;&lt; c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a9c10530886aa26b8dc86fd13846907e1">getMZ</a>(<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>) &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt;  c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a420f9a11eb02b46c5bb50b13b857ca95">getTransIntensity</a>(<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>) &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a5891967609c1abd65616dcd4456e41da">getRefIntensity</a>(<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>) &lt;&lt; std::endl;</div>
<div class="line"><a name="l00425"></a><span class="lineno">  425</span>&#160;                  }</div>
<div class="line"><a name="l00426"></a><span class="lineno">  426</span>&#160;                  ofile.close();</div>
<div class="line"><a name="l00427"></a><span class="lineno">  427</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00428"></a><span class="lineno">  428</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00429"></a><span class="lineno">  429</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00430"></a><span class="lineno">  430</span>&#160;<span class="preprocessor"></span>                  std::cout &lt;&lt; <span class="stringliteral">&quot;cuda transform for charge &quot;</span> &lt;&lt; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> + 1 &lt;&lt; <span class="stringliteral">&quot;  O.K. ... &quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00431"></a><span class="lineno">  431</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00432"></a><span class="lineno">  432</span>&#160;<span class="preprocessor"></span>                  this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00433"></a><span class="lineno">  433</span>&#160;</div>
<div class="line"><a name="l00434"></a><span class="lineno">  434</span>&#160;                  iwt-&gt;identifyChargeCuda(*c_trans, i, c, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">intensity_threshold_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ac0914e52b60b67388b6ca7648922b447">check_PPMs_</a>);</div>
<div class="line"><a name="l00435"></a><span class="lineno">  435</span>&#160;</div>
<div class="line"><a name="l00436"></a><span class="lineno">  436</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00437"></a><span class="lineno">  437</span>&#160;<span class="preprocessor"></span>                  std::cout &lt;&lt; <span class="stringliteral">&quot;cuda charge recognition for charge &quot;</span> &lt;&lt; c + 1 &lt;&lt; <span class="stringliteral">&quot; O.K.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00438"></a><span class="lineno">  438</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00439"></a><span class="lineno">  439</span>&#160;<span class="preprocessor"></span>                  this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00440"></a><span class="lineno">  440</span>&#160;                }</div>
<div class="line"><a name="l00441"></a><span class="lineno">  441</span>&#160;                iwt-&gt;finalizeScanCuda();</div>
<div class="line"><a name="l00442"></a><span class="lineno">  442</span>&#160;              }</div>
<div class="line"><a name="l00443"></a><span class="lineno">  443</span>&#160;              <span class="keywordflow">else</span></div>
<div class="line"><a name="l00444"></a><span class="lineno">  444</span>&#160;              {</div>
<div class="line"><a name="l00445"></a><span class="lineno">  445</span>&#160;                std::cout &lt;&lt; <span class="stringliteral">&quot;Warning/Error generated at scan &quot;</span> &lt;&lt; i &lt;&lt; <span class="stringliteral">&quot; (&quot;</span> &lt;&lt; ((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]).getRT() &lt;&lt; <span class="stringliteral">&quot;).&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00446"></a><span class="lineno">  446</span>&#160;              }</div>
<div class="line"><a name="l00447"></a><span class="lineno">  447</span>&#160;            }</div>
<div class="line"><a name="l00448"></a><span class="lineno">  448</span>&#160;            <span class="keywordflow">else</span>                     <span class="comment">//HighRes data</span></div>
<div class="line"><a name="l00449"></a><span class="lineno">  449</span>&#160;            {</div>
<div class="line"><a name="l00450"></a><span class="lineno">  450</span>&#160;              c_trans = <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a512f34fae6d03198dea390c33e52e75d">prepareHRDataCuda</a>(i, iwt);</div>
<div class="line"><a name="l00451"></a><span class="lineno">  451</span>&#160;              <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> &lt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>; ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>)</div>
<div class="line"><a name="l00452"></a><span class="lineno">  452</span>&#160;              {</div>
<div class="line"><a name="l00453"></a><span class="lineno">  453</span>&#160;                iwt-&gt;getTransformCuda(*c_trans, <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a>);</div>
<div class="line"><a name="l00454"></a><span class="lineno">  454</span>&#160;</div>
<div class="line"><a name="l00455"></a><span class="lineno">  455</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00456"></a><span class="lineno">  456</span>&#160;<span class="preprocessor"></span>                std::stringstream stream;</div>
<div class="line"><a name="l00457"></a><span class="lineno">  457</span>&#160;                stream &lt;&lt; <span class="stringliteral">&quot;gpu_highres_&quot;</span> &lt;&lt; ((*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>)[i]).getRT() &lt;&lt; <span class="stringliteral">&quot;_&quot;</span> &lt;&lt; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> + 1 &lt;&lt; <span class="stringliteral">&quot;.trans\0&quot;</span>;</div>
<div class="line"><a name="l00458"></a><span class="lineno">  458</span>&#160;                std::ofstream ofile(stream.str().c_str());</div>
<div class="line"><a name="l00459"></a><span class="lineno">  459</span>&#160;                <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> = 0; <a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a> &lt; c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a9d78a687cf2a391198bb3cbc08bc06cb">size</a>(); ++<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>)</div>
<div class="line"><a name="l00460"></a><span class="lineno">  460</span>&#160;                {</div>
<div class="line"><a name="l00461"></a><span class="lineno">  461</span>&#160;                  ofile &lt;&lt; ::std::setprecision(8) &lt;&lt; std::fixed &lt;&lt; c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a9c10530886aa26b8dc86fd13846907e1">getMZ</a>(<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>) &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt;  c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a420f9a11eb02b46c5bb50b13b857ca95">getTransIntensity</a>(<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>)  &lt;&lt; <span class="stringliteral">&quot;\t&quot;</span> &lt;&lt; c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a5891967609c1abd65616dcd4456e41da">getRefIntensity</a>(<a class="code" href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">k</a>) &lt;&lt; std::endl;</div>
<div class="line"><a name="l00462"></a><span class="lineno">  462</span>&#160;                }</div>
<div class="line"><a name="l00463"></a><span class="lineno">  463</span>&#160;                ofile.close();</div>
<div class="line"><a name="l00464"></a><span class="lineno">  464</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00465"></a><span class="lineno">  465</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00466"></a><span class="lineno">  466</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00467"></a><span class="lineno">  467</span>&#160;<span class="preprocessor"></span>                std::cout &lt;&lt; <span class="stringliteral">&quot;cuda transform for charge &quot;</span> &lt;&lt; <a class="code" href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">c</a> + 1 &lt;&lt; <span class="stringliteral">&quot;  O.K. ... &quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00468"></a><span class="lineno">  468</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00469"></a><span class="lineno">  469</span>&#160;<span class="preprocessor"></span>                this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00470"></a><span class="lineno">  470</span>&#160;</div>
<div class="line"><a name="l00471"></a><span class="lineno">  471</span>&#160;                iwt-&gt;identifyChargeCuda(*c_trans, i, c, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">intensity_threshold_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ac0914e52b60b67388b6ca7648922b447">check_PPMs_</a>);</div>
<div class="line"><a name="l00472"></a><span class="lineno">  472</span>&#160;</div>
<div class="line"><a name="l00473"></a><span class="lineno">  473</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00474"></a><span class="lineno">  474</span>&#160;<span class="preprocessor"></span>                std::cout &lt;&lt; <span class="stringliteral">&quot;cuda charge recognition for charge &quot;</span> &lt;&lt; c + 1 &lt;&lt; <span class="stringliteral">&quot; O.K.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00475"></a><span class="lineno">  475</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00476"></a><span class="lineno">  476</span>&#160;<span class="preprocessor"></span>                this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">setProgress</a>(++<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>);</div>
<div class="line"><a name="l00477"></a><span class="lineno">  477</span>&#160;              }</div>
<div class="line"><a name="l00478"></a><span class="lineno">  478</span>&#160;              c_trans-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#aed2d208f4d304cc6def0a15b73f115bf">destroy</a>();</div>
<div class="line"><a name="l00479"></a><span class="lineno">  479</span>&#160;              iwt-&gt;finalizeScanCuda();</div>
<div class="line"><a name="l00480"></a><span class="lineno">  480</span>&#160;            }</div>
<div class="line"><a name="l00481"></a><span class="lineno">  481</span>&#160;</div>
<div class="line"><a name="l00482"></a><span class="lineno">  482</span>&#160;            <span class="keyword">delete</span> (new_spec); new_spec = <a class="code" href="IsotopeWaveletParallelFor_8h.html#a070d2ce7b6bb7e5c05602aa8c308d0c4">NULL</a>;</div>
<div class="line"><a name="l00483"></a><span class="lineno">  483</span>&#160;            <span class="keyword">delete</span> (c_trans); c_trans = <a class="code" href="IsotopeWaveletParallelFor_8h.html#a070d2ce7b6bb7e5c05602aa8c308d0c4">NULL</a>;</div>
<div class="line"><a name="l00484"></a><span class="lineno">  484</span>&#160;</div>
<div class="line"><a name="l00485"></a><span class="lineno">  485</span>&#160;<span class="preprocessor">#else</span></div>
<div class="line"><a name="l00486"></a><span class="lineno">  486</span>&#160;<span class="preprocessor"></span>            std::cerr &lt;&lt; <span class="stringliteral">&quot;Error: You requested computation on GPU, but OpenMS has not been configured for CUDA usage.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00487"></a><span class="lineno">  487</span>&#160;            std::cerr &lt;&lt; <span class="stringliteral">&quot;Error: You need to rebuild OpenMS using the configure flag \&quot;--enable-cuda\&quot;.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00488"></a><span class="lineno">  488</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00489"></a><span class="lineno">  489</span>&#160;<span class="preprocessor"></span>          }</div>
<div class="line"><a name="l00490"></a><span class="lineno">  490</span>&#160;</div>
<div class="line"><a name="l00491"></a><span class="lineno">  491</span>&#160;          iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#ac0b48539bdee44dbe1368bcfd412f33f">updateBoxStates</a>(*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>, i, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a0864e2810fe75ef5519f320c957efb1b">RT_interleave_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">real_RT_votes_cutoff_</a>);</div>
<div class="line"><a name="l00492"></a><span class="lineno">  492</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00493"></a><span class="lineno">  493</span>&#160;<span class="preprocessor"></span>          std::cout &lt;&lt; <span class="stringliteral">&quot;updated box states.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00494"></a><span class="lineno">  494</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00495"></a><span class="lineno">  495</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00496"></a><span class="lineno">  496</span>&#160;          std::cout.flush();</div>
<div class="line"><a name="l00497"></a><span class="lineno">  497</span>&#160;        }</div>
<div class="line"><a name="l00498"></a><span class="lineno">  498</span>&#160;</div>
<div class="line"><a name="l00499"></a><span class="lineno">  499</span>&#160;        this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">ff_</a>-&gt;<a class="code" href="classOpenMS_1_1ProgressLogger.html#a1cc1012b0cdaea97f58d571af1ff45de">endProgress</a>();</div>
<div class="line"><a name="l00500"></a><span class="lineno">  500</span>&#160;</div>
<div class="line"><a name="l00501"></a><span class="lineno">  501</span>&#160;        <span class="comment">//Forces to empty OpenBoxes_ and to synchronize ClosedBoxes_</span></div>
<div class="line"><a name="l00502"></a><span class="lineno">  502</span>&#160;        iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#ac0b48539bdee44dbe1368bcfd412f33f">updateBoxStates</a>(*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>, INT_MAX, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a0864e2810fe75ef5519f320c957efb1b">RT_interleave_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">real_RT_votes_cutoff_</a>);</div>
<div class="line"><a name="l00503"></a><span class="lineno">  503</span>&#160;</div>
<div class="line"><a name="l00504"></a><span class="lineno">  504</span>&#160;<span class="preprocessor">#ifdef OPENMS_DEBUG_ISOTOPE_WAVELET</span></div>
<div class="line"><a name="l00505"></a><span class="lineno">  505</span>&#160;<span class="preprocessor"></span>        std::cout &lt;&lt; <span class="stringliteral">&quot;Final mapping.&quot;</span>; std::cout.flush();</div>
<div class="line"><a name="l00506"></a><span class="lineno">  506</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00507"></a><span class="lineno">  507</span>&#160;<span class="preprocessor"></span>        *this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a5f09052343ef99616ad653897841ce3e">features_</a> = iwt-&gt;<a class="code" href="classOpenMS_1_1IsotopeWaveletTransform.html#a12db861a7fd5db1a8aea9e6c4a403a89">mapSeeds2Features</a>(*this-&gt;<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">map_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">real_RT_votes_cutoff_</a>);</div>
<div class="line"><a name="l00508"></a><span class="lineno">  508</span>&#160;</div>
<div class="line"><a name="l00509"></a><span class="lineno">  509</span>&#160;        <span class="keyword">delete</span> (iwt);</div>
<div class="line"><a name="l00510"></a><span class="lineno">  510</span>&#160;      }</div>
<div class="line"><a name="l00511"></a><span class="lineno">  511</span>&#160;      <span class="keywordflow">else</span></div>
<div class="line"><a name="l00512"></a><span class="lineno">  512</span>&#160;      {</div>
<div class="line"><a name="l00513"></a><span class="lineno">  513</span>&#160;<span class="preprocessor">#ifndef OPENMS_HAS_TBB</span></div>
<div class="line"><a name="l00514"></a><span class="lineno">  514</span>&#160;<span class="preprocessor"></span>        std::cerr &lt;&lt; <span class="stringliteral">&quot;Error: You requested multi-threaded computation via threading building blocks, but OpenMS has not been configured for TBB usage.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00515"></a><span class="lineno">  515</span>&#160;        std::cerr &lt;&lt; <span class="stringliteral">&quot;Error: You need to rebuild OpenMS with -DENABLE_TBB=ON.&quot;</span> &lt;&lt; std::endl;</div>
<div class="line"><a name="l00516"></a><span class="lineno">  516</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00517"></a><span class="lineno">  517</span>&#160;<span class="preprocessor"></span>      }</div>
<div class="line"><a name="l00518"></a><span class="lineno">  518</span>&#160;    }</div>
<div class="line"><a name="l00519"></a><span class="lineno">  519</span>&#160;</div>
<div class="line"><a name="l00520"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af73fd15708e50e77665070023a09cc87">  520</a></span>&#160;    <span class="keyword">static</span> <span class="keyword">const</span> <a class="code" href="classOpenMS_1_1String.html">String</a> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af73fd15708e50e77665070023a09cc87">getProductName</a>()</div>
<div class="line"><a name="l00521"></a><span class="lineno">  521</span>&#160;    {</div>
<div class="line"><a name="l00522"></a><span class="lineno">  522</span>&#160;      <span class="keywordflow">return</span> <span class="stringliteral">&quot;isotope_wavelet&quot;</span>;</div>
<div class="line"><a name="l00523"></a><span class="lineno">  523</span>&#160;    }</div>
<div class="line"><a name="l00524"></a><span class="lineno">  524</span>&#160;</div>
<div class="line"><a name="l00525"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a81483ea6deb5aa7b6e11d0c3c871f532">  525</a></span>&#160;    <span class="keyword">static</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithm.html">FeatureFinderAlgorithm&lt;PeakType, FeatureType&gt;</a> * <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a81483ea6deb5aa7b6e11d0c3c871f532">create</a>()</div>
<div class="line"><a name="l00526"></a><span class="lineno">  526</span>&#160;    {</div>
<div class="line"><a name="l00527"></a><span class="lineno">  527</span>&#160;      <span class="keywordflow">return</span> <span class="keyword">new</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3ee942662a8e6bbd9a705201a1896666">FeatureFinderAlgorithmIsotopeWavelet</a>();</div>
<div class="line"><a name="l00528"></a><span class="lineno">  528</span>&#160;    }</div>
<div class="line"><a name="l00529"></a><span class="lineno">  529</span>&#160;</div>
<div class="line"><a name="l00530"></a><span class="lineno">  530</span>&#160;<span class="keyword">protected</span>:</div>
<div class="line"><a name="l00531"></a><span class="lineno">  531</span>&#160;</div>
<div class="line"><a name="l00533"></a><span class="lineno"><a class="line" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html">  533</a></span>&#160;    <span class="keyword">struct </span><a class="code" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html">BoxElement</a></div>
<div class="line"><a name="l00534"></a><span class="lineno">  534</span>&#160;    {</div>
<div class="line"><a name="l00535"></a><span class="lineno"><a class="line" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#ae7800b5f37aa029e53c6776f1952cdc7">  535</a></span>&#160;      <a class="code" href="classdouble.html">DoubleReal</a> <a class="code" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#ae7800b5f37aa029e53c6776f1952cdc7">mz</a>;</div>
<div class="line"><a name="l00536"></a><span class="lineno"><a class="line" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#a6d47e4bb5a579f9dd390c2a4f07a3cd3">  536</a></span>&#160;      <a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#a6d47e4bb5a579f9dd390c2a4f07a3cd3">c</a>;       </div>
<div class="line"><a name="l00537"></a><span class="lineno"><a class="line" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#aa2ac7da25c2023e7cf03863e5b907fd9">  537</a></span>&#160;      <a class="code" href="classdouble.html">DoubleReal</a> <a class="code" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#aa2ac7da25c2023e7cf03863e5b907fd9">score</a>;</div>
<div class="line"><a name="l00538"></a><span class="lineno"><a class="line" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#a991a665a859b92931ef2ddccea7d98c5">  538</a></span>&#160;      <a class="code" href="classdouble.html">DoubleReal</a> <a class="code" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#a991a665a859b92931ef2ddccea7d98c5">intens</a>;</div>
<div class="line"><a name="l00539"></a><span class="lineno"><a class="line" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#afc4478a0397a76fef003746ff45fc201">  539</a></span>&#160;      <a class="code" href="classdouble.html">DoubleReal</a> <a class="code" href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#afc4478a0397a76fef003746ff45fc201">RT</a>;       </div>
<div class="line"><a name="l00540"></a><span class="lineno">  540</span>&#160;    };</div>
<div class="line"><a name="l00541"></a><span class="lineno">  541</span>&#160;</div>
<div class="line"><a name="l00542"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae0878340ed972926f2d75b7196ac65c9">  542</a></span>&#160;    <span class="keyword">typedef</span> std::map&lt;UInt, BoxElement&gt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae0878340ed972926f2d75b7196ac65c9">Box</a>;     </div>
<div class="line"><a name="l00543"></a><span class="lineno">  543</span>&#160;</div>
<div class="line"><a name="l00544"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">  544</a></span>&#160;    <a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>;     </div>
<div class="line"><a name="l00545"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">  545</a></span>&#160;    <a class="code" href="classdouble.html">DoubleReal</a> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">intensity_threshold_</a>;     </div>
<div class="line"><a name="l00546"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3fd609fd7b023618f7f2c5c64e8ed803">  546</a></span>&#160;    <a class="code" href="classunsigned_01int.html">UInt</a> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3fd609fd7b023618f7f2c5c64e8ed803">RT_votes_cutoff_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">real_RT_votes_cutoff_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a0864e2810fe75ef5519f320c957efb1b">RT_interleave_</a>;     </div>
<div class="line"><a name="l00547"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3de08d2b695a532ae39b30bd7c46e68a">  547</a></span>&#160;    <a class="code" href="classOpenMS_1_1String.html">String</a> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3de08d2b695a532ae39b30bd7c46e68a">use_gpus_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a17a0a86ea1bf9a231c53429ea99e086b">intensity_type_</a>;</div>
<div class="line"><a name="l00548"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">  548</a></span>&#160;    <span class="keywordtype">bool</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae8f10b1319ef92b7f0ed3a31aaab93a9">use_cuda_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ac0914e52b60b67388b6ca7648922b447">check_PPMs_</a>, <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af082d2d0e78145cb7e949f3e6a4d92a7">hr_data_</a>;</div>
<div class="line"><a name="l00549"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">  549</a></span>&#160;    std::vector&lt;UInt&gt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>;     </div>
<div class="line"><a name="l00550"></a><span class="lineno">  550</span>&#160;</div>
<div class="line"><a name="l00551"></a><span class="lineno">  551</span>&#160;<span class="preprocessor">#if defined(OPENMS_HAS_TBB) &amp;&amp; defined(OPENMS_HAS_CUDA)</span></div>
<div class="line"><a name="l00552"></a><span class="lineno">  552</span>&#160;<span class="preprocessor"></span>    tbb::atomic&lt;int&gt; <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>;</div>
<div class="line"><a name="l00553"></a><span class="lineno">  553</span>&#160;    <a class="code" href="group__Concept.html#ga7cc214a236ad3bb6ad435bdcf5262a3f">Int</a> device_num_, gpu_to_exclude_;</div>
<div class="line"><a name="l00554"></a><span class="lineno">  554</span>&#160;<span class="preprocessor">#else</span></div>
<div class="line"><a name="l00555"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">  555</a></span>&#160;<span class="preprocessor"></span>    <a class="code" href="group__Concept.html#ga7cc214a236ad3bb6ad435bdcf5262a3f">Int</a> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">progress_counter_</a>;</div>
<div class="line"><a name="l00556"></a><span class="lineno">  556</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00557"></a><span class="lineno">  557</span>&#160;<span class="preprocessor"></span></div>
<div class="line"><a name="l00558"></a><span class="lineno"><a class="line" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#aaf258e1a9846d9b238ee4b3005ad3ee9">  558</a></span>&#160;    <span class="keywordtype">void</span> <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#aaf258e1a9846d9b238ee4b3005ad3ee9">updateMembers_</a>()</div>
<div class="line"><a name="l00559"></a><span class="lineno">  559</span>&#160;    {</div>
<div class="line"><a name="l00560"></a><span class="lineno">  560</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a> = this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;max_charge&quot;</span>);</div>
<div class="line"><a name="l00561"></a><span class="lineno">  561</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">intensity_threshold_</a> = this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;intensity_threshold&quot;</span>);</div>
<div class="line"><a name="l00562"></a><span class="lineno">  562</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3fd609fd7b023618f7f2c5c64e8ed803">RT_votes_cutoff_</a> = this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;sweep_line:rt_votes_cutoff&quot;</span>);</div>
<div class="line"><a name="l00563"></a><span class="lineno">  563</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a0864e2810fe75ef5519f320c957efb1b">RT_interleave_</a> = this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;sweep_line:rt_interleave&quot;</span>);</div>
<div class="line"><a name="l00564"></a><span class="lineno">  564</span>&#160;      <a class="code" href="classOpenMS_1_1IsotopeWavelet.html#aa18cf670f680c9c2eb6930d640e65b22">IsotopeWavelet::setMaxCharge</a>(<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">max_charge_</a>);</div>
<div class="line"><a name="l00565"></a><span class="lineno">  565</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ac0914e52b60b67388b6ca7648922b447">check_PPMs_</a> = ((<a class="code" href="classOpenMS_1_1String.html">String</a>)(this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;check_ppm&quot;</span>)) == <span class="stringliteral">&quot;true&quot;</span>);</div>
<div class="line"><a name="l00566"></a><span class="lineno">  566</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af082d2d0e78145cb7e949f3e6a4d92a7">hr_data_</a> = ((<a class="code" href="classOpenMS_1_1String.html">String</a>)(this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;hr_data&quot;</span>)) == <span class="stringliteral">&quot;true&quot;</span>);</div>
<div class="line"><a name="l00567"></a><span class="lineno">  567</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a17a0a86ea1bf9a231c53429ea99e086b">intensity_type_</a> = ((<a class="code" href="classOpenMS_1_1String.html">String</a>)(this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;intensity_type&quot;</span>)));</div>
<div class="line"><a name="l00568"></a><span class="lineno">  568</span>&#160;<span class="preprocessor">#if defined(OPENMS_HAS_CUDA) || defined(OPENMS_HAS_TBB)</span></div>
<div class="line"><a name="l00569"></a><span class="lineno">  569</span>&#160;<span class="preprocessor"></span>      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3de08d2b695a532ae39b30bd7c46e68a">use_gpus_</a> = this-&gt;<a class="code" href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">param_</a>.<a class="code" href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">getValue</a>(<span class="stringliteral">&quot;parallel:use_gpus&quot;</span>);</div>
<div class="line"><a name="l00570"></a><span class="lineno">  570</span>&#160;      std::vector&lt;String&gt; tokens;</div>
<div class="line"><a name="l00571"></a><span class="lineno">  571</span>&#160;      <span class="keywordflow">if</span> (!<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3de08d2b695a532ae39b30bd7c46e68a">use_gpus_</a>.<a class="code" href="classOpenMS_1_1String.html#ae580d960e12c7f0ebc5c95931cf39ad5">split</a>(<span class="charliteral">&#39;,&#39;</span>, tokens))</div>
<div class="line"><a name="l00572"></a><span class="lineno">  572</span>&#160;      {</div>
<div class="line"><a name="l00573"></a><span class="lineno">  573</span>&#160;        tokens.push_back(<a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3de08d2b695a532ae39b30bd7c46e68a">use_gpus_</a>);</div>
<div class="line"><a name="l00574"></a><span class="lineno">  574</span>&#160;      }</div>
<div class="line"><a name="l00575"></a><span class="lineno">  575</span>&#160;      <span class="comment">//Attention: updateMembers_ can be called several times!</span></div>
<div class="line"><a name="l00576"></a><span class="lineno">  576</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>.clear();</div>
<div class="line"><a name="l00577"></a><span class="lineno">  577</span>&#160;      <span class="keywordflow">if</span> (tokens[0].trim().toInt() == -1)           <span class="comment">//no parallelization</span></div>
<div class="line"><a name="l00578"></a><span class="lineno">  578</span>&#160;      {</div>
<div class="line"><a name="l00579"></a><span class="lineno">  579</span>&#160;        <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae8f10b1319ef92b7f0ed3a31aaab93a9">use_cuda_</a> = <span class="keyword">false</span>;</div>
<div class="line"><a name="l00580"></a><span class="lineno">  580</span>&#160;        <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a> = <span class="keyword">false</span>;</div>
<div class="line"><a name="l00581"></a><span class="lineno">  581</span>&#160;        <span class="keywordflow">return</span>;</div>
<div class="line"><a name="l00582"></a><span class="lineno">  582</span>&#160;      }</div>
<div class="line"><a name="l00583"></a><span class="lineno">  583</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>.push_back(tokens[0].trim().toInt());</div>
<div class="line"><a name="l00584"></a><span class="lineno">  584</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae8f10b1319ef92b7f0ed3a31aaab93a9">use_cuda_</a> = <span class="keyword">true</span>;</div>
<div class="line"><a name="l00585"></a><span class="lineno">  585</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a> = <span class="keyword">false</span>;</div>
<div class="line"><a name="l00586"></a><span class="lineno">  586</span>&#160;      <span class="keywordflow">for</span> (<a class="code" href="classunsigned_01int.html">UInt</a> i = 1; i &lt; tokens.size(); ++i)</div>
<div class="line"><a name="l00587"></a><span class="lineno">  587</span>&#160;      {</div>
<div class="line"><a name="l00588"></a><span class="lineno">  588</span>&#160;        <span class="keywordflow">if</span> (tokens[i].trim().toInt() == (<a class="code" href="group__Concept.html#ga7cc214a236ad3bb6ad435bdcf5262a3f">Int</a>) <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>[i - 1])</div>
<div class="line"><a name="l00589"></a><span class="lineno">  589</span>&#160;        {</div>
<div class="line"><a name="l00590"></a><span class="lineno">  590</span>&#160;          <span class="keywordflow">continue</span>;</div>
<div class="line"><a name="l00591"></a><span class="lineno">  591</span>&#160;        }</div>
<div class="line"><a name="l00592"></a><span class="lineno">  592</span>&#160;        <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">gpu_ids_</a>.push_back(tokens[i].trim().toInt());</div>
<div class="line"><a name="l00593"></a><span class="lineno">  593</span>&#160;        <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a> = <span class="keyword">true</span>;</div>
<div class="line"><a name="l00594"></a><span class="lineno">  594</span>&#160;      }</div>
<div class="line"><a name="l00595"></a><span class="lineno">  595</span>&#160;<span class="preprocessor">#else</span></div>
<div class="line"><a name="l00596"></a><span class="lineno">  596</span>&#160;<span class="preprocessor"></span>      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae8f10b1319ef92b7f0ed3a31aaab93a9">use_cuda_</a> = <span class="keyword">false</span>;</div>
<div class="line"><a name="l00597"></a><span class="lineno">  597</span>&#160;      <a class="code" href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">use_tbb_</a> = <span class="keyword">false</span>;</div>
<div class="line"><a name="l00598"></a><span class="lineno">  598</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="line"><a name="l00599"></a><span class="lineno">  599</span>&#160;<span class="preprocessor"></span>    }</div>
<div class="line"><a name="l00600"></a><span class="lineno">  600</span>&#160;</div>
<div class="line"><a name="l00601"></a><span class="lineno">  601</span>&#160;  };</div>
<div class="line"><a name="l00602"></a><span class="lineno">  602</span>&#160;</div>
<div class="line"><a name="l00603"></a><span class="lineno">  603</span>&#160;} <span class="comment">//namespace</span></div>
<div class="line"><a name="l00604"></a><span class="lineno">  604</span>&#160;</div>
<div class="line"><a name="l00605"></a><span class="lineno">  605</span>&#160;<span class="preprocessor">#endif</span></div>
<div class="ttc" id="namespaceOpenMS_1_1Constants_html_a53aae8780a5fb5cca0b69ece3f1c226c"><div class="ttname"><a href="namespaceOpenMS_1_1Constants.html#a53aae8780a5fb5cca0b69ece3f1c226c">OpenMS::Constants::CUDA_INIT_SUCCESS</a></div><div class="ttdeci">const int CUDA_INIT_SUCCESS</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletConstants.h:92</div></div>
<div class="ttc" id="namespaceOpenMS_1_1Constants_html_a93a8dc068053ec44ee7e45864ef969f7"><div class="ttname"><a href="namespaceOpenMS_1_1Constants.html#a93a8dc068053ec44ee7e45864ef969f7">OpenMS::Constants::k</a></div><div class="ttdeci">const double k</div></div>
<div class="ttc" id="classunsigned_01int_html"><div class="ttname"><a href="classunsigned_01int.html">unsigned int</a></div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_html_a12db861a7fd5db1a8aea9e6c4a403a89"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform.html#a12db861a7fd5db1a8aea9e6c4a403a89">OpenMS::IsotopeWaveletTransform::mapSeeds2Features</a></div><div class="ttdeci">FeatureMap&lt; Feature &gt; mapSeeds2Features(const MSExperiment&lt; PeakType &gt; &amp;map, const UInt RT_votes_cutoff)</div><div class="ttdoc">Filters the candidates further more and maps the internally used data structures to the OpenMS framew...</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:2313</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_html_a54c204f5b2d6a44874df21661e992224"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform.html#a54c204f5b2d6a44874df21661e992224">OpenMS::IsotopeWaveletTransform::getTransform</a></div><div class="ttdeci">virtual void getTransform(MSSpectrum&lt; PeakType &gt; &amp;c_trans, const MSSpectrum&lt; PeakType &gt; &amp;c_ref, const UInt c)</div><div class="ttdoc">Computes the isotope wavelet transform of charge state c. </div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:693</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithm_html_a5f09052343ef99616ad653897841ce3e"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithm.html#a5f09052343ef99616ad653897841ce3e">OpenMS::FeatureFinderAlgorithm::features_</a></div><div class="ttdeci">FeatureMapType * features_</div><div class="ttdoc">Output data pointer. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithm.h:144</div></div>
<div class="ttc" id="classOpenMS_1_1DefaultParamHandler_html_a761b1937850c141d0c6fff0e4d633a04"><div class="ttname"><a href="classOpenMS_1_1DefaultParamHandler.html#a761b1937850c141d0c6fff0e4d633a04">OpenMS::DefaultParamHandler::defaults_</a></div><div class="ttdeci">Param defaults_</div><div class="ttdoc">Container for default parameters. This member should be filled in the constructor of derived classes!...</div><div class="ttdef"><b>Definition:</b> DefaultParamHandler.h:155</div></div>
<div class="ttc" id="classOpenMS_1_1Param_html_a432099944e11263aa20aaf8ea1389790"><div class="ttname"><a href="classOpenMS_1_1Param.html#a432099944e11263aa20aaf8ea1389790">OpenMS::Param::setValue</a></div><div class="ttdeci">void setValue(const String &amp;key, const DataValue &amp;value, const String &amp;description=&quot;&quot;, const StringList &amp;tags=StringList())</div><div class="ttdoc">Sets a value. </div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum_html_aed2d208f4d304cc6def0a15b73f115bf"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#aed2d208f4d304cc6def0a15b73f115bf">OpenMS::IsotopeWaveletTransform::TransSpectrum::destroy</a></div><div class="ttdeci">virtual void destroy()</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:137</div></div>
<div class="ttc" id="classOpenMS_1_1String_html"><div class="ttname"><a href="classOpenMS_1_1String.html">OpenMS::String</a></div><div class="ttdoc">A more convenient string class. </div><div class="ttdef"><b>Definition:</b> String.h:56</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithm_html_adf68cb378c76b322b2cc4dbb2c145a3e"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithm.html#adf68cb378c76b322b2cc4dbb2c145a3e">OpenMS::FeatureFinderAlgorithm::ff_</a></div><div class="ttdeci">FeatureFinder * ff_</div><div class="ttdoc">Pointer to the calling FeatureFinder that is used to access the feature flags. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithm.h:147</div></div>
<div class="ttc" id="classOpenMS_1_1MSExperiment_html_a9d78a687cf2a391198bb3cbc08bc06cb"><div class="ttname"><a href="classOpenMS_1_1MSExperiment.html#a9d78a687cf2a391198bb3cbc08bc06cb">OpenMS::MSExperiment::size</a></div><div class="ttdeci">Size size() const </div><div class="ttdef"><b>Definition:</b> MSExperiment.h:117</div></div>
<div class="ttc" id="classOpenMS_1_1Peak2D_html_a2694f0775c46d9076355cb85d9815425"><div class="ttname"><a href="classOpenMS_1_1Peak2D.html#a2694f0775c46d9076355cb85d9815425">OpenMS::Peak2D::setMZ</a></div><div class="ttdeci">void setMZ(CoordinateType coordinate)</div><div class="ttdoc">Mutable access to the m/z coordinate (index 1) </div><div class="ttdef"><b>Definition:</b> Peak2D.h:197</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a3de08d2b695a532ae39b30bd7c46e68a"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3de08d2b695a532ae39b30bd7c46e68a">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::use_gpus_</a></div><div class="ttdeci">String use_gpus_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:547</div></div>
<div class="ttc" id="classOpenMS_1_1DefaultParamHandler_html_a28c73e623c63a4fe3bfceb1ae8274f39"><div class="ttname"><a href="classOpenMS_1_1DefaultParamHandler.html#a28c73e623c63a4fe3bfceb1ae8274f39">OpenMS::DefaultParamHandler::param_</a></div><div class="ttdeci">Param param_</div><div class="ttdoc">Container for current parameters. </div><div class="ttdef"><b>Definition:</b> DefaultParamHandler.h:148</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a40b4eaf0409b4d2ffff61e83e35aba41"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a40b4eaf0409b4d2ffff61e83e35aba41">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::use_tbb_</a></div><div class="ttdeci">bool use_tbb_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:548</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithm_html_a365c5cf67d48519199fe00cb5688d628"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithm.html#a365c5cf67d48519199fe00cb5688d628">OpenMS::FeatureFinderAlgorithm::map_</a></div><div class="ttdeci">const MapType * map_</div><div class="ttdoc">Input data pointer. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithm.h:141</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a7837c64b8bc2ae095bf949d6ea9fe2d5"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a7837c64b8bc2ae095bf949d6ea9fe2d5">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::Base</a></div><div class="ttdeci">FeatureFinderAlgorithm&lt; PeakType, FeatureType &gt; Base</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:85</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWavelet_html_aa18cf670f680c9c2eb6930d640e65b22"><div class="ttname"><a href="classOpenMS_1_1IsotopeWavelet.html#aa18cf670f680c9c2eb6930d640e65b22">OpenMS::IsotopeWavelet::setMaxCharge</a></div><div class="ttdeci">static void setMaxCharge(const UInt max_charge)</div><div class="ttdoc">Sets the max_charge parameter. </div><div class="ttdef"><b>Definition:</b> IsotopeWavelet.h:116</div></div>
<div class="ttc" id="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement_html_aa2ac7da25c2023e7cf03863e5b907fd9"><div class="ttname"><a href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#aa2ac7da25c2023e7cf03863e5b907fd9">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::BoxElement::score</a></div><div class="ttdeci">DoubleReal score</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:537</div></div>
<div class="ttc" id="ProgressLogger_8h_html"><div class="ttname"><a href="ProgressLogger_8h.html">ProgressLogger.h</a></div></div>
<div class="ttc" id="IsotopeWaveletParallelFor_8h_html_a070d2ce7b6bb7e5c05602aa8c308d0c4"><div class="ttname"><a href="IsotopeWaveletParallelFor_8h.html#a070d2ce7b6bb7e5c05602aa8c308d0c4">NULL</a></div><div class="ttdeci">#define NULL</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletParallelFor.h:41</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_ae0878340ed972926f2d75b7196ac65c9"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae0878340ed972926f2d75b7196ac65c9">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::Box</a></div><div class="ttdeci">std::map&lt; UInt, BoxElement &gt; Box</div><div class="ttdoc">Key: RT (index), value: BoxElement. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:542</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithm_html"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithm.html">OpenMS::FeatureFinderAlgorithm</a></div><div class="ttdoc">Abstract base class for FeatureFinder algorithms. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithm.h:74</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a0864e2810fe75ef5519f320c957efb1b"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a0864e2810fe75ef5519f320c957efb1b">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::RT_interleave_</a></div><div class="ttdeci">UInt RT_interleave_</div><div class="ttdoc">The number of subsequent scans a pattern must cover in order to be considered as signal. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:546</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_af73fd15708e50e77665070023a09cc87"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af73fd15708e50e77665070023a09cc87">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::getProductName</a></div><div class="ttdeci">static const String getProductName()</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:520</div></div>
<div class="ttc" id="classdouble_html"><div class="ttname"><a href="classdouble.html">double</a></div></div>
<div class="ttc" id="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement_html_a6d47e4bb5a579f9dd390c2a4f07a3cd3"><div class="ttname"><a href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#a6d47e4bb5a579f9dd390c2a4f07a3cd3">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::BoxElement::c</a></div><div class="ttdeci">UInt c</div><div class="ttdoc">Note, this is not the charge (it is charge-1!!!) </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:536</div></div>
<div class="ttc" id="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement_html_ae7800b5f37aa029e53c6776f1952cdc7"><div class="ttname"><a href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#ae7800b5f37aa029e53c6776f1952cdc7">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::BoxElement::mz</a></div><div class="ttdeci">DoubleReal mz</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:535</div></div>
<div class="ttc" id="namespaceOpenMS_1_1Constants_html_a8fc6defe4e499b1b9b9c275689e44352"><div class="ttname"><a href="namespaceOpenMS_1_1Constants.html#a8fc6defe4e499b1b9b9c275689e44352">OpenMS::Constants::c</a></div><div class="ttdeci">const double c</div></div>
<div class="ttc" id="classOpenMS_1_1RangeManager_html_ab54df5a3894df5cebc88022e8684ff65"><div class="ttname"><a href="classOpenMS_1_1RangeManager.html#ab54df5a3894df5cebc88022e8684ff65">OpenMS::RangeManager::getMax</a></div><div class="ttdeci">const PositionType &amp; getMax() const </div><div class="ttdoc">Returns the maximum position. </div><div class="ttdef"><b>Definition:</b> RangeManager.h:115</div></div>
<div class="ttc" id="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement_html_a991a665a859b92931ef2ddccea7d98c5"><div class="ttname"><a href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#a991a665a859b92931ef2ddccea7d98c5">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::BoxElement::intens</a></div><div class="ttdeci">DoubleReal intens</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:538</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum_html"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html">OpenMS::IsotopeWaveletTransform::TransSpectrum</a></div><div class="ttdoc">Internally (only by GPUs) used data structure . It allows efficient data exchange between CPU and GPU...</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:112</div></div>
<div class="ttc" id="MzDataFile_8h_html"><div class="ttname"><a href="MzDataFile_8h.html">MzDataFile.h</a></div></div>
<div class="ttc" id="classOpenMS_1_1Peak2D_html_ab875c2479c6cd2a0189e4684bfa4f97d"><div class="ttname"><a href="classOpenMS_1_1Peak2D.html#ab875c2479c6cd2a0189e4684bfa4f97d">OpenMS::Peak2D::setIntensity</a></div><div class="ttdeci">void setIntensity(IntensityType intensity)</div><div class="ttdoc">Non-mutable access to the data point intensity (height) </div><div class="ttdef"><b>Definition:</b> Peak2D.h:167</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_html_ad9ced5a5293256ab54096986d28d693f"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform.html#ad9ced5a5293256ab54096986d28d693f">OpenMS::IsotopeWaveletTransform::getTransformHighRes</a></div><div class="ttdeci">virtual void getTransformHighRes(MSSpectrum&lt; PeakType &gt; &amp;c_trans, const MSSpectrum&lt; PeakType &gt; &amp;c_ref, const UInt c)</div><div class="ttdoc">Computes the isotope wavelet transform of charge state c. </div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:736</div></div>
<div class="ttc" id="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement_html"><div class="ttname"><a href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::BoxElement</a></div><div class="ttdoc">Internally used data structure for the sweep line algorithm. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:533</div></div>
<div class="ttc" id="classOpenMS_1_1MSSpectrum_html"><div class="ttname"><a href="classOpenMS_1_1MSSpectrum.html">OpenMS::MSSpectrum&lt; PeakType &gt;</a></div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum_html_a9c10530886aa26b8dc86fd13846907e1"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a9c10530886aa26b8dc86fd13846907e1">OpenMS::IsotopeWaveletTransform::TransSpectrum::getMZ</a></div><div class="ttdeci">DoubleReal getMZ(const UInt i) const </div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:152</div></div>
<div class="ttc" id="classOpenMS_1_1ProgressLogger_html_a1cc1012b0cdaea97f58d571af1ff45de"><div class="ttname"><a href="classOpenMS_1_1ProgressLogger.html#a1cc1012b0cdaea97f58d571af1ff45de">OpenMS::ProgressLogger::endProgress</a></div><div class="ttdeci">void endProgress() const </div><div class="ttdoc">Ends the progress display. </div></div>
<div class="ttc" id="classOpenMS_1_1Param_html_abd0f5571675ec99e1aa647b39e2a8711"><div class="ttname"><a href="classOpenMS_1_1Param.html#abd0f5571675ec99e1aa647b39e2a8711">OpenMS::Param::getValue</a></div><div class="ttdeci">const DataValue &amp; getValue(const String &amp;key) const </div><div class="ttdoc">Returns a value of a parameter. </div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a522648bd9fecc67681ffdbf0a15b3139"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a522648bd9fecc67681ffdbf0a15b3139">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::~FeatureFinderAlgorithmIsotopeWavelet</a></div><div class="ttdeci">virtual ~FeatureFinderAlgorithmIsotopeWavelet()</div><div class="ttdoc">Destructor. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:132</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_ae8f10b1319ef92b7f0ed3a31aaab93a9"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ae8f10b1319ef92b7f0ed3a31aaab93a9">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::use_cuda_</a></div><div class="ttdeci">bool use_cuda_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:548</div></div>
<div class="ttc" id="IsotopeWaveletParallelFor_8h_html"><div class="ttname"><a href="IsotopeWaveletParallelFor_8h.html">IsotopeWaveletParallelFor.h</a></div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_html_ab99b362c90b6915c337cc919b73b599f"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform.html#ab99b362c90b6915c337cc919b73b599f">OpenMS::IsotopeWaveletTransform::initializeScan</a></div><div class="ttdeci">virtual void initializeScan(const MSSpectrum&lt; PeakType &gt; &amp;c_ref, const UInt c=0)</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:774</div></div>
<div class="ttc" id="classOpenMS_1_1RangeManager_html_ad7e9497afbc70b1bd40dba2874802954"><div class="ttname"><a href="classOpenMS_1_1RangeManager.html#ad7e9497afbc70b1bd40dba2874802954">OpenMS::RangeManager::getMin</a></div><div class="ttdeci">const PositionType &amp; getMin() const </div><div class="ttdoc">Returns the minimum position. </div><div class="ttdef"><b>Definition:</b> RangeManager.h:109</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_html"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform.html">OpenMS::IsotopeWaveletTransform</a></div><div class="ttdoc">A class implementing the isotope wavelet transform. If you just want to find features using the isoto...</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:87</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a792fce9b5d6d0fe62dfd0303b33e557b"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a792fce9b5d6d0fe62dfd0303b33e557b">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::intensity_threshold_</a></div><div class="ttdeci">DoubleReal intensity_threshold_</div><div class="ttdoc">The only parameter of the isotope wavelet. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:545</div></div>
<div class="ttc" id="IsotopeWaveletTransform_8h_html"><div class="ttname"><a href="IsotopeWaveletTransform_8h.html">IsotopeWaveletTransform.h</a></div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html">OpenMS::FeatureFinderAlgorithmIsotopeWavelet</a></div><div class="ttdoc">Implements the isotope wavelet feature finder. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:76</div></div>
<div class="ttc" id="classOpenMS_1_1StringList_html_a5f86b59b547048311dd50df5fb6d3bb5"><div class="ttname"><a href="classOpenMS_1_1StringList.html#a5f86b59b547048311dd50df5fb6d3bb5">OpenMS::StringList::create</a></div><div class="ttdeci">static StringList create(const String &amp;list, const char splitter= ',')</div><div class="ttdoc">Returns a list that is created by splitting the given (comma-separated) string (String are not trimme...</div></div>
<div class="ttc" id="FeatureFinderAlgorithm_8h_html"><div class="ttname"><a href="FeatureFinderAlgorithm_8h.html">FeatureFinderAlgorithm.h</a></div></div>
<div class="ttc" id="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement_html_afc4478a0397a76fef003746ff45fc201"><div class="ttname"><a href="structOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_1_1BoxElement.html#afc4478a0397a76fef003746ff45fc201">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::BoxElement::RT</a></div><div class="ttdeci">DoubleReal RT</div><div class="ttdoc">The elution time (not the scan index) </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:539</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_html_ac0b48539bdee44dbe1368bcfd412f33f"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform.html#ac0b48539bdee44dbe1368bcfd412f33f">OpenMS::IsotopeWaveletTransform::updateBoxStates</a></div><div class="ttdeci">void updateBoxStates(const MSExperiment&lt; PeakType &gt; &amp;map, const Size scan_index, const UInt RT_interleave, const UInt RT_votes_cutoff, const Int front_bound=-1, const Int end_bound=-1)</div><div class="ttdoc">A function keeping track of currently open and closed sweep line boxes. This function is used by the ...</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:2029</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a80a937e9a0dd8e9426bd2e0051ecaa33"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a80a937e9a0dd8e9426bd2e0051ecaa33">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::createHRData</a></div><div class="ttdeci">MSSpectrum&lt; PeakType &gt; * createHRData(const UInt i)</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:145</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_aaf258e1a9846d9b238ee4b3005ad3ee9"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#aaf258e1a9846d9b238ee4b3005ad3ee9">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::updateMembers_</a></div><div class="ttdeci">void updateMembers_()</div><div class="ttdoc">This method is used to update extra member variables at the end of the setParameters() method...</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:558</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_html_ad7b38b52b1b16ca069e80ff8b8618295"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform.html#ad7b38b52b1b16ca069e80ff8b8618295">OpenMS::IsotopeWaveletTransform::identifyCharge</a></div><div class="ttdeci">virtual void identifyCharge(const MSSpectrum&lt; PeakType &gt; &amp;candidates, const MSSpectrum&lt; PeakType &gt; &amp;ref, const UInt scan_index, const UInt c, const DoubleReal ampl_cutoff, const bool check_PPMs)</div><div class="ttdoc">Given an isotope wavelet transformed spectrum candidates, this function assigns to every significant ...</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:1180</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a17a0a86ea1bf9a231c53429ea99e086b"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a17a0a86ea1bf9a231c53429ea99e086b">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::intensity_type_</a></div><div class="ttdeci">String intensity_type_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:547</div></div>
<div class="ttc" id="classOpenMS_1_1Param_html_a10933782584a46cded91c40574027ee2"><div class="ttname"><a href="classOpenMS_1_1Param.html#a10933782584a46cded91c40574027ee2">OpenMS::Param::setValidStrings</a></div><div class="ttdeci">void setValidStrings(const String &amp;key, const std::vector&lt; String &gt; &amp;strings)</div><div class="ttdoc">Sets the valid strings for the parameter key. </div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum_html_a420f9a11eb02b46c5bb50b13b857ca95"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a420f9a11eb02b46c5bb50b13b857ca95">OpenMS::IsotopeWaveletTransform::TransSpectrum::getTransIntensity</a></div><div class="ttdeci">DoubleReal getTransIntensity(const UInt i) const </div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:164</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a512f34fae6d03198dea390c33e52e75d"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a512f34fae6d03198dea390c33e52e75d">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::prepareHRDataCuda</a></div><div class="ttdeci">IsotopeWaveletTransform&lt; PeakType &gt;::TransSpectrum * prepareHRDataCuda(const UInt i, IsotopeWaveletTransform&lt; PeakType &gt; *iwt)</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:136</div></div>
<div class="ttc" id="classOpenMS_1_1ProgressLogger_html_af67907baa897e9fb84df0cb89795b87ca3ab34dd50405af2d5a62627d572f7860"><div class="ttname"><a href="classOpenMS_1_1ProgressLogger.html#af67907baa897e9fb84df0cb89795b87ca3ab34dd50405af2d5a62627d572f7860">OpenMS::ProgressLogger::CMD</a></div><div class="ttdoc">Command line progress. </div><div class="ttdef"><b>Definition:</b> ProgressLogger.h:68</div></div>
<div class="ttc" id="classOpenMS_1_1Param_html_a3a23089ec40eeed796efe7b69ecb02ac"><div class="ttname"><a href="classOpenMS_1_1Param.html#a3a23089ec40eeed796efe7b69ecb02ac">OpenMS::Param::setMinInt</a></div><div class="ttdeci">void setMinInt(const String &amp;key, Int min)</div><div class="ttdoc">Sets the minimum value for the integer or integer list parameter key. </div></div>
<div class="ttc" id="classOpenMS_1_1MSSpectrum_html_aac8c50f318154e9e5b7b01aee806e17f"><div class="ttname"><a href="classOpenMS_1_1MSSpectrum.html#aac8c50f318154e9e5b7b01aee806e17f">OpenMS::MSSpectrum::setRT</a></div><div class="ttdeci">void setRT(DoubleReal rt)</div><div class="ttdoc">Sets the absolute retention time (is seconds) </div><div class="ttdef"><b>Definition:</b> MSSpectrum.h:221</div></div>
<div class="ttc" id="group__Concept_html_gaf9ecec2d692138fab9167164a457cbd4"><div class="ttname"><a href="group__Concept.html#gaf9ecec2d692138fab9167164a457cbd4">OpenMS::Size</a></div><div class="ttdeci">size_t Size</div><div class="ttdoc">Size type e.g. used as variable which can hold result of size() </div><div class="ttdef"><b>Definition:</b> Types.h:144</div></div>
<div class="ttc" id="classOpenMS_1_1ProgressLogger_html_af1c45ecd71b5041b70319249e8e73591"><div class="ttname"><a href="classOpenMS_1_1ProgressLogger.html#af1c45ecd71b5041b70319249e8e73591">OpenMS::ProgressLogger::startProgress</a></div><div class="ttdeci">void startProgress(SignedSize begin, SignedSize end, const String &amp;label) const </div><div class="ttdoc">Initializes the progress display. </div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_af082d2d0e78145cb7e949f3e6a4d92a7"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af082d2d0e78145cb7e949f3e6a4d92a7">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::hr_data_</a></div><div class="ttdeci">bool hr_data_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:548</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletParallelFor_html"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletParallelFor.html">OpenMS::IsotopeWaveletParallelFor</a></div><div class="ttdoc">A class for distributing the data over several GPUs using Intel Threading Building Blocks...</div><div class="ttdef"><b>Definition:</b> IsotopeWaveletParallelFor.h:52</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a10c429e143b68ec85d225b005e0d752c"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a10c429e143b68ec85d225b005e0d752c">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::progress_counter_</a></div><div class="ttdeci">Int progress_counter_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:555</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a32280019a7d0e19a07e0c3fd44aee972"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a32280019a7d0e19a07e0c3fd44aee972">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::max_charge_</a></div><div class="ttdeci">UInt max_charge_</div><div class="ttdoc">The maximal charge state we will consider. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:544</div></div>
<div class="ttc" id="classOpenMS_1_1ProgressLogger_html_a8852277abd03220cc7b80d6c1bed6fed"><div class="ttname"><a href="classOpenMS_1_1ProgressLogger.html#a8852277abd03220cc7b80d6c1bed6fed">OpenMS::ProgressLogger::setProgress</a></div><div class="ttdeci">void setProgress(SignedSize value) const </div><div class="ttdoc">Sets the current progress. </div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum_html_a9d78a687cf2a391198bb3cbc08bc06cb"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a9d78a687cf2a391198bb3cbc08bc06cb">OpenMS::IsotopeWaveletTransform::TransSpectrum::size</a></div><div class="ttdeci">Size size() const </div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:176</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a3ee942662a8e6bbd9a705201a1896666"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3ee942662a8e6bbd9a705201a1896666">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::FeatureFinderAlgorithmIsotopeWavelet</a></div><div class="ttdeci">FeatureFinderAlgorithmIsotopeWavelet()</div><div class="ttdoc">Default Constructor. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:89</div></div>
<div class="ttc" id="classOpenMS_1_1MSSpectrum_html_a3da529bd3240fa0d7148484bbef0b9d7"><div class="ttname"><a href="classOpenMS_1_1MSSpectrum.html#a3da529bd3240fa0d7148484bbef0b9d7">OpenMS::MSSpectrum::getRT</a></div><div class="ttdeci">DoubleReal getRT() const </div><div class="ttdef"><b>Definition:</b> MSSpectrum.h:215</div></div>
<div class="ttc" id="classOpenMS_1_1ConstRefVector_html"><div class="ttname"><a href="classOpenMS_1_1ConstRefVector.html">OpenMS::ConstRefVector</a></div><div class="ttdoc">This vector holds pointer to the elements of another container. </div><div class="ttdef"><b>Definition:</b> ConstRefVector.h:72</div></div>
<div class="ttc" id="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum_html_a5891967609c1abd65616dcd4456e41da"><div class="ttname"><a href="classOpenMS_1_1IsotopeWaveletTransform_1_1TransSpectrum.html#a5891967609c1abd65616dcd4456e41da">OpenMS::IsotopeWaveletTransform::TransSpectrum::getRefIntensity</a></div><div class="ttdeci">DoubleReal getRefIntensity(const UInt i) const </div><div class="ttdef"><b>Definition:</b> IsotopeWaveletTransform.h:158</div></div>
<div class="ttc" id="classOpenMS_1_1ConstRefVector_html_a86f7b200260209865e730a2e4fcaa628"><div class="ttname"><a href="classOpenMS_1_1ConstRefVector.html#a86f7b200260209865e730a2e4fcaa628">OpenMS::ConstRefVector::sortByPosition</a></div><div class="ttdeci">void sortByPosition()</div><div class="ttdoc">Lexicographically sorts the elements by their position. </div><div class="ttdef"><b>Definition:</b> ConstRefVector.h:766</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a3fd609fd7b023618f7f2c5c64e8ed803"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a3fd609fd7b023618f7f2c5c64e8ed803">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::RT_votes_cutoff_</a></div><div class="ttdeci">UInt RT_votes_cutoff_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:546</div></div>
<div class="ttc" id="group__Concept_html_ga7cc214a236ad3bb6ad435bdcf5262a3f"><div class="ttname"><a href="group__Concept.html#ga7cc214a236ad3bb6ad435bdcf5262a3f">OpenMS::Int</a></div><div class="ttdeci">int Int</div><div class="ttdoc">Signed integer type. </div><div class="ttdef"><b>Definition:</b> Types.h:100</div></div>
<div class="ttc" id="classOpenMS_1_1String_html_ae580d960e12c7f0ebc5c95931cf39ad5"><div class="ttname"><a href="classOpenMS_1_1String.html#ae580d960e12c7f0ebc5c95931cf39ad5">OpenMS::String::split</a></div><div class="ttdeci">bool split(const char splitter, std::vector&lt; String &gt; &amp;substrings, bool quote_protect=false) const </div><div class="ttdoc">Splits a string into substrings using splitter as delimiter. </div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a81483ea6deb5aa7b6e11d0c3c871f532"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a81483ea6deb5aa7b6e11d0c3c871f532">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::create</a></div><div class="ttdeci">static FeatureFinderAlgorithm&lt; PeakType, FeatureType &gt; * create()</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:525</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_a13a43e6d814de94978c515cb084873b1"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#a13a43e6d814de94978c515cb084873b1">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::run</a></div><div class="ttdeci">void run()</div><div class="ttdoc">The working horse of this class. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:223</div></div>
<div class="ttc" id="FeatureMap_8h_html"><div class="ttname"><a href="FeatureMap_8h.html">FeatureMap.h</a></div></div>
<div class="ttc" id="classOpenMS_1_1ProgressLogger_html_acc3538c5284777d8702ccaefeb61e74c"><div class="ttname"><a href="classOpenMS_1_1ProgressLogger.html#acc3538c5284777d8702ccaefeb61e74c">OpenMS::ProgressLogger::setLogType</a></div><div class="ttdeci">void setLogType(LogType type) const </div><div class="ttdoc">Sets the progress log that should be used. The default type is NONE! </div></div>
<div class="ttc" id="classOpenMS_1_1DefaultParamHandler_html_a2802c591e6d7fd3fd9cc35f5e875d0ba"><div class="ttname"><a href="classOpenMS_1_1DefaultParamHandler.html#a2802c591e6d7fd3fd9cc35f5e875d0ba">OpenMS::DefaultParamHandler::defaultsToParam_</a></div><div class="ttdeci">void defaultsToParam_()</div><div class="ttdoc">Updates the parameters after the defaults have been set in the constructor. </div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_ac0914e52b60b67388b6ca7648922b447"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ac0914e52b60b67388b6ca7648922b447">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::check_PPMs_</a></div><div class="ttdeci">bool check_PPMs_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:548</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_ab9444d66ec037a0f90523b6ac87c9087"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#ab9444d66ec037a0f90523b6ac87c9087">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::real_RT_votes_cutoff_</a></div><div class="ttdeci">UInt real_RT_votes_cutoff_</div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:546</div></div>
<div class="ttc" id="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet_html_af8edb64f6f222069d7e8d143d4034213"><div class="ttname"><a href="classOpenMS_1_1FeatureFinderAlgorithmIsotopeWavelet.html#af8edb64f6f222069d7e8d143d4034213">OpenMS::FeatureFinderAlgorithmIsotopeWavelet::gpu_ids_</a></div><div class="ttdeci">std::vector&lt; UInt &gt; gpu_ids_</div><div class="ttdoc">A list of all GPU devices that can be used. </div><div class="ttdef"><b>Definition:</b> FeatureFinderAlgorithmIsotopeWavelet.h:549</div></div>
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<TD><font color="#c0c0c0">OpenMS / TOPP release 1.11.1</font></TD>
<TD align="right"><font color="#c0c0c0">Documentation generated on Thu Nov 14 2013 11:19:13 using doxygen 1.8.5</font></TD>
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