File: KIM_ModelCompute.hpp

package info (click to toggle)
kim-api 2.4.1-1~exp1
  • links: PTS, VCS
  • area: main
  • in suites: experimental
  • size: 4,624 kB
  • sloc: cpp: 32,594; f90: 12,746; ansic: 3,041; sh: 1,283; lisp: 130; python: 35; makefile: 13
file content (120 lines) | stat: -rw-r--r-- 3,836 bytes parent folder | download | duplicates (2)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
//
// KIM-API: An API for interatomic models
// Copyright (c) 2013--2022, Regents of the University of Minnesota.
// All rights reserved.
//
// Contributors:
//    Ryan S. Elliott
//
// SPDX-License-Identifier: LGPL-2.1-or-later
//
// This library is free software; you can redistribute it and/or
// modify it under the terms of the GNU Lesser General Public
// License as published by the Free Software Foundation; either
// version 2.1 of the License, or (at your option) any later version.
//
// This library is distributed in the hope that it will be useful,
// but WITHOUT ANY WARRANTY; without even the implied warranty of
// MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the GNU
// Lesser General Public License for more details.
//
// You should have received a copy of the GNU Lesser General Public License
// along with this library; if not, write to the Free Software Foundation,
// Inc., 51 Franklin Street, Fifth Floor, Boston, MA  02110-1301  USA
//

//
// Release: This file is part of the kim-api.git repository.
//


#ifndef KIM_MODEL_COMPUTE_HPP_
#define KIM_MODEL_COMPUTE_HPP_

#include <sstream>
#include <string>

namespace KIM
{
// Forward declarations
class LogVerbosity;
class ModelComputeImplementation;


/// \brief Provides the interface to a %KIM API Model object for use by models
/// within their MODEL_ROUTINE_NAME::Compute routine.
///
/// \sa KIM_ModelCompute,
/// kim_model_compute_module::kim_model_compute_handle_type
///
/// \since 2.0
class ModelCompute
{
 public:
  /// \brief Get the \ref cache_buffer_pointers "Model's buffer pointer"
  /// within the Model object.
  ///
  /// The model buffer pointer may be used by the Model to associate
  /// a memory buffer with the Model object.
  ///
  /// \param[out] ptr The model buffer data pointer.
  ///
  /// \note `ptr == NULL` if the model has not previously called
  ///       ModelCreate::SetModelBufferPointer or
  ///       ModelDriverCreate::SetModelBufferPointer.
  ///
  /// \sa KIM_ModelCompute_GetModelBufferPointer,
  /// kim_model_compute_module::kim_get_model_buffer_pointer
  ///
  /// \since 2.0
  void GetModelBufferPointer(void ** const ptr) const;

  /// \brief Write a log entry into the log file.
  ///
  /// This results in a no-op if \c logVerbosity is LOG_VERBOSITY::silent or if
  /// \c logVerbosity is greater-than the Log object's top LogVerbosity on its
  /// stack.
  ///
  /// \param[in] logVerbosity The LogVerbosity level for the entry.
  /// \param[in] message The body text of the log entry.
  /// \param[in] lineNumber The source code file line number.
  /// \param[in] fileName The source code file name.
  ///
  /// \sa KIM_ModelCompute_LogEntry, kim_model_compute_module::kim_log_entry
  ///
  /// \since 2.0
  void LogEntry(LogVerbosity const logVerbosity,
                std::string const & message,
                int const lineNumber,
                std::string const & fileName) const;

  /// \overload
  void LogEntry(LogVerbosity const logVerbosity,
                std::stringstream const & message,
                int const lineNumber,
                std::string const & fileName) const;

  /// \brief Get a string representing the internal state of the Model object.
  ///
  /// This string is primarily meant for use as a debugging tool.  The string
  /// may be quite long.  It begins and ends with lines consisting only of \c
  /// ='s.
  ///
  /// \sa KIM_ModelCompute_ToString, kim_model_compute_module::kim_to_string
  ///
  /// \since 2.0
  std::string const & ToString() const;

 private:
  // do not allow copy constructor or operator=
  ModelCompute(ModelCompute const &);
  void operator=(ModelCompute const &);

  ModelCompute();
  ~ModelCompute();

  ModelComputeImplementation * pimpl;
};  // class ModelCompute
}  // namespace KIM

#endif  // KIM_MODEL_COMPUTE_HPP_