plumed_md_test.cpp File Reference

#include "gmxpre.h"
#include <limits>
#include <numeric>
#include <sstream>
#include <string>
#include <gtest/gtest.h>
#include "gromacs/fileio/confio.h"
#include "gromacs/topology/topology.h"
#include "gromacs/utility/filestream.h"
#include "gromacs/utility/path.h"
#include "gromacs/utility/stringstream.h"
#include "gromacs/utility/stringutil.h"
#include "gromacs/utility/textwriter.h"
#include "testutils/cmdlinetest.h"
#include "testutils/mpitest.h"
#include "testutils/refdata.h"
#include "testutils/simulationdatabase.h"
#include "testutils/testasserts.h"
#include "testutils/testfilemanager.h"
#include "testutils/trajectoryreader.h"
#include "programs/mdrun/mdrun_main.h"
#include "programs/mdrun/tests/moduletest.h"
#include "programs/mdrun/tests/trajectorycomparison.h"
#include "plumedTestUtils.h"

Include dependency graph for plumed_md_test.cpp:

Description

Tests for a simple run using Plumed MDModule.

Author

Daniele Rapetti drape.nosp@m.tti@.nosp@m.sissa.nosp@m..it