replicaexchange_equivalence.cpp File Reference

#include "gmxpre.h"
#include "config.h"
#include <filesystem>
#include <memory>
#include <regex>
#include <string>
#include <tuple>
#include <gtest/gtest.h>
#include "gromacs/mdtypes/md_enums.h"
#include "gromacs/topology/ifunc.h"
#include "gromacs/utility/basenetwork.h"
#include "gromacs/utility/filestream.h"
#include "gromacs/utility/path.h"
#include "gromacs/utility/stringutil.h"
#include "testutils/cmdlinetest.h"
#include "testutils/refdata.h"
#include "testutils/testasserts.h"
#include "testutils/testfilemanager.h"
#include "programs/mdrun/tests/comparison_helpers.h"
#include "programs/mdrun/tests/moduletest.h"
#include "energycomparison.h"
#include "multisimtest.h"
#include "trajectorycomparison.h"

Include dependency graph for replicaexchange_equivalence.cpp:

Description

Equivalence tests for the mdrun replica-exchange functionality.

Author

Mark Abraham mark..nosp@m.j.ab.nosp@m.raham.nosp@m.@gma.nosp@m.il.co.nosp@m.m

Classes
struct	gmx::test::PrintReplicaExchangeParametersToString
	Helper struct printing custom test name. More...

Typedefs
typedef MultiSimTest	gmx::test::ReplicaExchangeTest
	Convenience typedef.

Functions
static std::string	gmx::test::getReplicaExchangeOutputFromLogFile (const std::string &logFileName)
	Return replica exchange related output from logfile. More...