Inheritance diagram for OpenMD::KirkwoodBuff:

Public Member Functions
	KirkwoodBuff (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2, RealType len, unsigned int nrbins)

unsigned int	getNRBins () const

RealType	getLength () const

Public Member Functions inherited from OpenMD::MultiComponentRDF
	MultiComponentRDF (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2, unsigned int nbins)

void	process ()

Public Member Functions inherited from OpenMD::StaticAnalyser
	StaticAnalyser (SimInfo *info, const std::string &filename, unsigned int nbins)

void	setOutputName (const std::string &filename)

const std::string &	getOutputFileName () const

void	setStep (int step)

int	getStep () const

const std::string &	getAnalysisType () const

void	setAnalysisType (const std::string &type)

void	setParameterString (const std::string &params)

Additional Inherited Members
Public Types inherited from OpenMD::MultiComponentRDF
enum	PairIndicies { OneOne , OneTwo , TwoTwo , MaxPairs }

Protected Member Functions inherited from OpenMD::MultiComponentRDF
virtual void	preProcess ()

virtual void	processNonOverlapping (SelectionManager &sman1, SelectionManager &sman2, int pairIndex)

virtual void	processOverlapping (SelectionManager &sman, int pairIndex)

std::vector< int >	getNPairs () const

int	getNSelected1 () const

int	getNSelected2 () const

Protected Member Functions inherited from OpenMD::StaticAnalyser
virtual void	writeOutput ()

Protected Attributes inherited from OpenMD::MultiComponentRDF
Snapshot *	currentSnapshot_

std::string	selectionScript1_

std::string	selectionScript2_

int	nProcessed_

SelectionEvaluator	evaluator1_

SelectionEvaluator	evaluator2_

SelectionManager	seleMan1_

SelectionManager	seleMan2_

SelectionManager	sele1_minus_common_

SelectionManager	sele2_minus_common_

SelectionManager	common_

Protected Attributes inherited from OpenMD::StaticAnalyser
SimInfo *	info_ {nullptr}

std::string	dumpFilename_

int	step_

unsigned int	nBins_

std::string	outputFilename_

std::string	analysisType_

std::string	paramString_

std::vector< OutputData >	data_

std::vector< AtomType * >	outputTypes_

Detailed Description

Definition at line 52 of file KirkwoodBuff.hpp.

Constructor & Destructor Documentation

OpenMD::KirkwoodBuff::KirkwoodBuff	(	SimInfo *	info,
		const std::string &	filename,
		const std::string &	sele1,
		const std::string &	sele2,
		RealType	len,
		unsigned int	nrbins )

Definition at line 58 of file KirkwoodBuff.cpp.

RealType OpenMD::KirkwoodBuff::getLength ( ) const

inline

Definition at line 59 of file KirkwoodBuff.hpp.

unsigned int OpenMD::KirkwoodBuff::getNRBins ( ) const

inline

Definition at line 58 of file KirkwoodBuff.hpp.

The documentation for this class was generated from the following files: