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<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.01 Transitional//EN">
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<title>rotamer.cpp File Reference</title>
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<div class="title">rotamer.cpp File Reference</div>  </div>
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<div class="textblock"><code>#include &lt;openbabel/babelconfig.h&gt;</code><br/>
<code>#include &lt;<a class="el" href="rotamer_8h_source.shtml">openbabel/rotamer.h</a>&gt;</code><br/>
</div><table class="memberdecls">
<tr><td colspan="2"><h2><a name="namespaces"></a>
Namespaces</h2></td></tr>
<tr><td class="memItemLeft" align="right" valign="top">namespace &#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml">OpenBabel</a></td></tr>
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Defines</h2></td></tr>
<tr><td class="memItemLeft" align="right" valign="top">#define&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="rotamer_8cpp.shtml#a2b7b465349a129829a8626910b4ec401">OB_TITLE_SIZE</a>&#160;&#160;&#160;254</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">#define&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="rotamer_8cpp.shtml#a936a5879f18723817586964a296c88aa">OB_BINARY_SETWORD</a>&#160;&#160;&#160;32</td></tr>
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Functions</h2></td></tr>
<tr><td class="memItemLeft" align="right" valign="top">double&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml#a9f0ec6e80141edbb924cfc4839117c94">rint</a> (double x)</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">void&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml#a3d3039fda855c4c8c37c8345f0b51a64">SetRotorToAngle</a> (double *c, OBAtom **ref, double ang, vector&lt; int &gt; atoms)</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">int&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml#a8b1ba3c73d4038fd69729fbeb588008a">Swab</a> (int)</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">int&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml#a69a83bcbc3a172e306c4556518aa0999">PackCoordinate</a> (double c[3], double max[3])</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">void&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml#a3180afc2c45b337a776dcc164e99e89a">UnpackCoordinate</a> (double c[3], double max[3], int tmp)</td></tr>
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Variables</h2></td></tr>
<tr><td class="memItemLeft" align="right" valign="top">static int&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml#ae3c640db1cce9cd703ef7c5429de5453">SINT</a> = 0x00000001</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">static unsigned char *&#160;</td><td class="memItemRight" valign="bottom"><a class="el" href="namespaceOpenBabel.shtml#a0cc646b14fcc04a16103f6bd73382d17">STPTR</a> = (unsigned char*)&amp;SINT</td></tr>
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<hr/><a name="details" id="details"></a><h2>Detailed Description</h2>
<div class="textblock"><p>Handle rotamer list data. </p>
</div><hr/><h2>Define Documentation</h2>
<a class="anchor" id="a2b7b465349a129829a8626910b4ec401"></a><!-- doxytag: member="rotamer.cpp::OB_TITLE_SIZE" ref="a2b7b465349a129829a8626910b4ec401" args="" -->
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          <td class="memname">#define OB_TITLE_SIZE&#160;&#160;&#160;254</td>
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<a class="anchor" id="a936a5879f18723817586964a296c88aa"></a><!-- doxytag: member="rotamer.cpp::OB_BINARY_SETWORD" ref="a936a5879f18723817586964a296c88aa" args="" -->
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          <td class="memname">#define OB_BINARY_SETWORD&#160;&#160;&#160;32</td>
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