OpenMD::EnergyCorrFunc Class Reference

Inheritance diagram for OpenMD::EnergyCorrFunc:

Public Member Functions
	EnergyCorrFunc (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2)
Public Member Functions inherited from OpenMD::FrameTimeCorrFunc< RealType >
	FrameTimeCorrFunc (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2, int storageLayout, long long int memSize)

Protected Member Functions
virtual void	computeProperty (int frame1)
virtual void	correlateFrames (int frame1, int frame2)
virtual RealType	calcCorrVal (int frame1, int frame2)

Protected Attributes
std::vector< Accumulator * >	E_a_
std::vector< Vector3d >	G_t_

Detailed Description

Definition at line 61 of file EnergyCorrFunc.hpp.

Constructor & Destructor Documentation

EnergyCorrFunc()

OpenMD::EnergyCorrFunc::EnergyCorrFunc	(	SimInfo *	info,
		const std::string &	filename,
		const std::string &	sele1,
		const std::string &	sele2 )

Definition at line 65 of file EnergyCorrFunc.cpp.

Member Function Documentation

calcCorrVal()

virtual RealType OpenMD::EnergyCorrFunc::calcCorrVal ( int frame1, int frame2 )

inlineprotectedvirtual

Implements OpenMD::FrameTimeCorrFunc< RealType >.

Definition at line 69 of file EnergyCorrFunc.hpp.

correlateFrames()

void OpenMD::EnergyCorrFunc::correlateFrames ( int frame1, int frame2 )

protectedvirtual

Reimplemented from OpenMD::FrameTimeCorrFunc< RealType >.

Definition at line 83 of file EnergyCorrFunc.cpp.

Member Data Documentation

E_a_

std::vector<Accumulator* > OpenMD::EnergyCorrFunc::E_a_

protected

Definition at line 71 of file EnergyCorrFunc.hpp.

G_t_

std::vector<Vector3d> OpenMD::EnergyCorrFunc::G_t_

protected

Definition at line 72 of file EnergyCorrFunc.hpp.

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

• applications/dynamicProps/old/EnergyCorrFunc.hpp
• applications/dynamicProps/old/EnergyCorrFunc.cpp