ProtoMol - an object-oriented component based framework for Molecular Dynamics simulations.
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iSGProtomol.cpp File Reference

#include "ConfigurationReader.h"
#include "InputPosVel.h"
#include "iSGPARReader.h"
#include "iSGIntegrator.h"
#include "ModifierISG.h"
#include "PSFReader.h"
#include "TRANSReader.h"
#include "TimerStatistic.h"
#include "TopologyFactory.h"
#include "ForceFactory.h"
#include "IntegratorFactory.h"
#include "OutputFactory.h"
#include "iSGregisterForceExemplars.h"
#include "iSGregisterIntegratorExemplars.h"
#include "registerTopologyExemplars.h"
#include "iSGregisterOutputExemplars.h"
#include "OutputCollection.h"
#include "Parameter.h"
#include "ScalarStructure.h"
#include "Parallel.h"
#include "ModifierRemoveLinearMomentum.h"
#include "ModifierRemoveAngularMomentum.h"
#include "GenericTopology.h"
#include "buildISGTopology.h"
#include "pmconstants.h"
#include "inputValueDefinitions.h"
#include "mathutilities.h"
#include "parseCommandLine.h"
#include "protomol.h"
#include "stringutilities.h"
#include "systemutilities.h"
#include "topologyutilities.h"

Functions

 declareInputValue (InputNumComp, INT, NOTNEGATIVE)
 declareInputValue (InputXSC, STRING, NOTEMPTY)
 declareInputValue (InputTRANS, STRING, NOTEMPTY)
 declareInputValue (InputReportFreq, BOOL, NOCONSTRAINTS)
 declareInputValue (InputTICalc, BOOL, NOCONSTRAINTS)
 defineInputValue (InputNumComp,"components")
 defineInputValue (InputXSC,"xscfile")
 defineInputValue (InputTRANS,"transfile")
 defineInputValue (InputReportFreq,"reportOnFreq")
 defineInputValue (InputTICalc,"TICalc")
int main (int argc, char **argv)

Function Documentation

declareInputValue (  InputTICalc  ,
BOOL  ,
NOCONSTRAINTS 
) 
 

declareInputValue (  InputReportFreq  ,
BOOL  ,
NOCONSTRAINTS 
) 
 

declareInputValue (  InputTRANS  ,
STRING  ,
NOTEMPTY 
) 
 

declareInputValue (  InputXSC  ,
STRING  ,
NOTEMPTY 
) 
 

declareInputValue (  InputNumComp  ,
INT  ,
NOTNEGATIVE 
) 
 

defineInputValue (  InputTICalc  ,
"TICalc" 
) 
 

defineInputValue (  InputReportFreq  ,
"reportOnFreq" 
) 
 

defineInputValue (  InputTRANS  ,
"transfile" 
) 
 

defineInputValue (  InputXSC  ,
"xscfile" 
) 
 

defineInputValue (  InputNumComp  ,
"components" 
) 
 

int main (  int  argc,
char **  argv
) 
 

Last update: . GNU GENERAL PUBLIC LICENSE, copyrighted by the University of Notre Dame and the University of Bergen, Norway.