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Typedefs | Functions | Variables
simulationdatabase.cpp File Reference
#include "gmxpre.h"
#include "simulationdatabase.h"
#include <algorithm>
#include <map>
#include <string>
#include "gromacs/utility/stringutil.h"
#include "testutils/testasserts.h"
+ Include dependency graph for simulationdatabase.cpp:

Description

Implements declarations from in simulationdatabase.h.

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

Typedefs

using gmx::test::anonymous_namespace{simulationdatabase.cpp}::MdpFileValues = std::map< std::string, DatabaseEntry >
 Helper typedef.
 

Functions

MdpFieldValues gmx::test::anonymous_namespace{simulationdatabase.cpp}::prepareDefaultMdpFieldValues (const std::string &simulationName)
 Prepare default .mdp values. More...
 
bool gmx::test::isNumberOfPpRanksSupported (const std::string &simulationName, int possibleNumberOfPpRanks)
 Return whether the number of ranks is supported by the simulation simulationName in the database. More...
 
std::string gmx::test::reportNumbersOfPpRanksSupported (const std::string &simulationName)
 Return a string describing the numbers of ranks supported for the simulation simulationName in the database.
 
MdpFieldValues gmx::test::prepareMdpFieldValues (const std::string &simulationName, const std::string &integrator, const std::string &tcoupl, const std::string &pcoupl)
 Set up values for an .mdp file that permits a highly reproducible simulation. More...
 
MdpFieldValues gmx::test::prepareMdpFieldValues (const char *simulationName, const char *integrator, const char *tcoupl, const char *pcoupl)
 Set up values for an .mdp file that permits a highly reproducible simulation. More...
 
std::string gmx::test::prepareMdpFileContents (const MdpFieldValues &mdpFieldValues)
 Make a string containing an .mdp file from the mdpFieldValues. More...
 

Variables

const MdpFileValues gmx::test::anonymous_namespace{simulationdatabase.cpp}::mdpFileValueDatabase_g
 Database of .mdp strings that supports prepareDefaultMdpValues()