Inheritance diagram for OpenMD::RNEMDRTheta:

Public Member Functions
	RNEMDRTheta (SimInfo *info, const std::string &filename, const std::string &sele, const std::string &comsele, int nrbins, RealType binWidth, int nanglebins)

void	processFrame (int frame)

void	processStuntDouble (StuntDouble *, int)

std::pair< int, int >	getBins (Vector3d pos)

void	writeOutput ()

Public Member Functions inherited from OpenMD::ShellStatistics
	ShellStatistics (SimInfo *info, const std::string &filename, const std::string &sele, const std::string &comsele, int nbins, RealType binWidth)

virtual int	getBin (Vector3d pos)

void	setCoordinateOrigin (Vector3d co)

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

virtual 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
Protected Attributes inherited from OpenMD::ShellStatistics
Vector3d	coordinateOrigin_

RealType	binWidth_

std::string	comSele_

SelectionManager	comSeleMan_

SelectionEvaluator	comEvaluator_

Protected Attributes inherited from OpenMD::SpatialStatistics
Snapshot *	currentSnapshot_

int	nProcessed_

std::string	selectionScript_

SelectionEvaluator	evaluator_

SelectionManager	seleMan_

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 111 of file RNEMDStats.hpp.

Constructor & Destructor Documentation

OpenMD::RNEMDRTheta::RNEMDRTheta	(	SimInfo *	info,
		const std::string &	filename,
		const std::string &	sele,
		const std::string &	comsele,
		int	nrbins,
		RealType	binWidth,
		int	nanglebins )

Definition at line 654 of file RNEMDStats.cpp.

std::pair< int, int > OpenMD::RNEMDRTheta::getBins ( Vector3d pos )

Definition at line 710 of file RNEMDStats.cpp.

void OpenMD::RNEMDRTheta::processFrame ( int frame )

virtual

Definition at line 721 of file RNEMDStats.cpp.

void OpenMD::RNEMDRTheta::processStuntDouble	(	StuntDouble *	,
		int	)

inlinevirtual

Definition at line 117 of file RNEMDStats.hpp.

void OpenMD::RNEMDRTheta::writeOutput ( )

virtual

Definition at line 786 of file RNEMDStats.cpp.

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