OpenMD::InversePowerSeries Class Reference

Inheritance diagram for OpenMD::InversePowerSeries:

Public Member Functions
void	setForceField (ForceField *ff)
void	setSimulatedAtomTypes (AtomTypeSet &simtypes)
void	addExplicitInteraction (AtomType *atype1, AtomType *atype2, std::vector< int > powers, std::vector< RealType > coefficients)
virtual void	calcForce (InteractionData &idat)
virtual string	getName ()
virtual int	getHash ()
virtual RealType	getSuggestedCutoffRadius (pair< AtomType *, AtomType * > atypes)
Public Member Functions inherited from OpenMD::VanDerWaalsInteraction
virtual InteractionFamily	getFamily ()

Detailed Description

Definition at line 61 of file InversePowerSeries.hpp.

Constructor & Destructor Documentation

InversePowerSeries()

OpenMD::InversePowerSeries::InversePowerSeries

(

)

Definition at line 58 of file InversePowerSeries.cpp.

Member Function Documentation

addExplicitInteraction()

void OpenMD::InversePowerSeries::addExplicitInteraction	(	AtomType *	atype1,
		AtomType *	atype2,
		std::vector< int >	powers,
		std::vector< RealType >	coefficients )

Definition at line 136 of file InversePowerSeries.cpp.

calcForce()

void OpenMD::InversePowerSeries::calcForce ( InteractionData & idat )

virtual

Implements OpenMD::NonBondedInteraction.

Definition at line 157 of file InversePowerSeries.cpp.

getHash()

virtual int OpenMD::InversePowerSeries::getHash ( )

inlinevirtual

Implements OpenMD::NonBondedInteraction.

Definition at line 74 of file InversePowerSeries.hpp.

getName()

virtual string OpenMD::InversePowerSeries::getName ( )

inlinevirtual

Implements OpenMD::NonBondedInteraction.

Definition at line 73 of file InversePowerSeries.hpp.

getSuggestedCutoffRadius()

RealType OpenMD::InversePowerSeries::getSuggestedCutoffRadius ( pair< AtomType *, AtomType * > atypes )

virtual

Implements OpenMD::NonBondedInteraction.

Definition at line 207 of file InversePowerSeries.cpp.

setForceField()

void OpenMD::InversePowerSeries::setForceField ( ForceField * ff )

inline

Definition at line 64 of file InversePowerSeries.hpp.

setSimulatedAtomTypes()

void OpenMD::InversePowerSeries::setSimulatedAtomTypes ( AtomTypeSet & simtypes )

inline

Definition at line 65 of file InversePowerSeries.hpp.

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

• nonbonded/InversePowerSeries.hpp
• nonbonded/InversePowerSeries.cpp