Split lines with many copyright years
[gromacs.git] / src / gromacs / analysisdata / dataproxy.cpp
blob24460bd78eaadd23e32434f156a0f0b15e0bd53f
1 /*
2 * This file is part of the GROMACS molecular simulation package.
4 * Copyright (c) 2010,2011,2012,2013,2014 by the GROMACS development team.
5 * Copyright (c) 2017,2019,2020, by the GROMACS development team, led by
6 * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
7 * and including many others, as listed in the AUTHORS file in the
8 * top-level source directory and at http://www.gromacs.org.
10 * GROMACS is free software; you can redistribute it and/or
11 * modify it under the terms of the GNU Lesser General Public License
12 * as published by the Free Software Foundation; either version 2.1
13 * of the License, or (at your option) any later version.
15 * GROMACS is distributed in the hope that it will be useful,
16 * but WITHOUT ANY WARRANTY; without even the implied warranty of
17 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
18 * Lesser General Public License for more details.
20 * You should have received a copy of the GNU Lesser General Public
21 * License along with GROMACS; if not, see
22 * http://www.gnu.org/licenses, or write to the Free Software Foundation,
23 * Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
25 * If you want to redistribute modifications to GROMACS, please
26 * consider that scientific software is very special. Version
27 * control is crucial - bugs must be traceable. We will be happy to
28 * consider code for inclusion in the official distribution, but
29 * derived work must not be called official GROMACS. Details are found
30 * in the README & COPYING files - if they are missing, get the
31 * official version at http://www.gromacs.org.
33 * To help us fund GROMACS development, we humbly ask that you cite
34 * the research papers on the package. Check out http://www.gromacs.org.
36 /*! \internal \file
37 * \brief
38 * Implements gmx::AnalysisDataProxy.
40 * \author Teemu Murtola <teemu.murtola@gmail.com>
41 * \ingroup module_analysisdata
43 #include "gmxpre.h"
45 #include "dataproxy.h"
47 #include "gromacs/analysisdata/dataframe.h"
48 #include "gromacs/analysisdata/datamodulemanager.h"
49 #include "gromacs/utility/gmxassert.h"
51 namespace gmx
54 AnalysisDataProxy::AnalysisDataProxy(int firstColumn, int columnSpan, AbstractAnalysisData* data) :
55 source_(*data),
56 firstColumn_(firstColumn),
57 columnSpan_(columnSpan),
58 bParallel_(false)
60 GMX_RELEASE_ASSERT(data != nullptr, "Source data must not be NULL");
61 GMX_RELEASE_ASSERT(firstColumn >= 0 && columnSpan > 0, "Invalid proxy column");
62 setMultipoint(source_.isMultipoint());
66 int AnalysisDataProxy::frameCount() const
68 return source_.frameCount();
72 AnalysisDataFrameRef AnalysisDataProxy::tryGetDataFrameInternal(int index) const
74 AnalysisDataFrameRef frame = source_.tryGetDataFrame(index);
75 if (!frame.isValid())
77 return AnalysisDataFrameRef();
79 return AnalysisDataFrameRef(frame, firstColumn_, columnSpan_);
83 bool AnalysisDataProxy::requestStorageInternal(int nframes)
85 return source_.requestStorage(nframes);
89 int AnalysisDataProxy::flags() const
91 return efAllowMultipoint | efAllowMulticolumn | efAllowMissing | efAllowMultipleDataSets;
95 void AnalysisDataProxy::dataStarted(AbstractAnalysisData* data)
97 GMX_RELEASE_ASSERT(data == &source_, "Source data mismatch");
98 setDataSetCount(data->dataSetCount());
99 for (int i = 0; i < data->dataSetCount(); ++i)
101 setColumnCount(i, columnSpan_);
103 moduleManager().notifyDataStart(this);
107 bool AnalysisDataProxy::parallelDataStarted(AbstractAnalysisData* data,
108 const AnalysisDataParallelOptions& options)
110 GMX_RELEASE_ASSERT(data == &source_, "Source data mismatch");
111 setDataSetCount(data->dataSetCount());
112 for (int i = 0; i < data->dataSetCount(); ++i)
114 setColumnCount(i, columnSpan_);
116 moduleManager().notifyParallelDataStart(this, options);
117 bParallel_ = !moduleManager().hasSerialModules();
118 return bParallel_;
122 void AnalysisDataProxy::frameStarted(const AnalysisDataFrameHeader& frame)
124 if (bParallel_)
126 moduleManager().notifyParallelFrameStart(frame);
128 else
130 moduleManager().notifyFrameStart(frame);
135 void AnalysisDataProxy::pointsAdded(const AnalysisDataPointSetRef& points)
137 AnalysisDataPointSetRef columns(points, firstColumn_, columnSpan_);
138 if (columns.columnCount() > 0)
140 if (bParallel_)
142 moduleManager().notifyParallelPointsAdd(columns);
144 else
146 moduleManager().notifyPointsAdd(columns);
152 void AnalysisDataProxy::frameFinished(const AnalysisDataFrameHeader& header)
154 if (bParallel_)
156 moduleManager().notifyParallelFrameFinish(header);
158 else
160 moduleManager().notifyFrameFinish(header);
164 void AnalysisDataProxy::frameFinishedSerial(int frameIndex)
166 if (bParallel_)
168 // The x and dx values are unused in this case.
169 AnalysisDataFrameHeader header(frameIndex, 0.0, 0.0);
170 moduleManager().notifyFrameFinish(header);
175 void AnalysisDataProxy::dataFinished()
177 moduleManager().notifyDataFinish();
180 } // namespace gmx