PLMD::ColvarOutput Class Reference

#include <ColvarOutput.h>

Classes
class	DerivHelper
class	VirialHelper

Public Member Functions
	ColvarOutput (View< double > v, std::size_t nderivPerComponent, double *derivatives)
Vector	getAtomDerivatives (std::size_t i, std::size_t a)

Static Public Member Functions
static ColvarOutput	createColvarOutput (std::vector< double > &v, std::vector< double > &d, Colvar *action)

Public Attributes
DerivHelper	derivs
std::size_t	ncomponents
View< double >	values
VirialHelper	virial

Constructor & Destructor Documentation

ColvarOutput()

PLMD::ColvarOutput::ColvarOutput ( View< double > v, std::size_t nderivPerComponent, double * derivatives )

inline

Member Function Documentation

createColvarOutput()

ColvarOutput PLMD::ColvarOutput::createColvarOutput ( std::vector< double > & v, std::vector< double > & d, Colvar * action )

static

getAtomDerivatives()

Vector PLMD::ColvarOutput::getAtomDerivatives ( std::size_t i, std::size_t a )

inline

Member Data Documentation

derivs

DerivHelper PLMD::ColvarOutput::derivs

ncomponents

std::size_t PLMD::ColvarOutput::ncomponents

values

View<double> PLMD::ColvarOutput::values

virial

VirialHelper PLMD::ColvarOutput::virial

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

• tools/ColvarOutput.h
• tools/ColvarOutput.cpp