Public Member Functions
	ReferenceCalcDensityForceKernel (std::string name, const OpenMM::Platform &platform)

	~ReferenceCalcDensityForceKernel ()

void	initialize (const OpenMM::System &system, const DensityForce &force)

double	execute (OpenMM::ContextImpl &context, bool includeForces, bool includeEnergy)

void	copyParametersToContext (OpenMM::ContextImpl &context, const DensityForce &force)

Public Member Functions inherited from CalcDensityForceKernel
	CalcDensityForceKernel (std::string name, const OpenMM::Platform &platform)

Additional Inherited Members
Static Public Member Functions inherited from CalcDensityForceKernel
static std::string	Name ()

Detailed Description

This kernel is invoked by DensityForce to calculate the forces acting on the system and the energy of the system.

Constructor & Destructor Documentation

ReferenceCalcDensityForceKernel	(	std::string	name,
		const OpenMM::Platform &	platform
	)

inline

~ReferenceCalcDensityForceKernel ( )

void copyParametersToContext	(	OpenMM::ContextImpl &	context,
		const DensityForce &	force
	)

virtual

Copy changed parameters over to a context.

Parameters

context	the context to copy parameters to
force	the DensityForce to copy the parameters from

virtual

Execute the kernel to calculate the forces and/or energy.

Parameters

context	the context in which to execute this kernel
includeForces	true if forces should be calculated
includeEnergy	true if the energy should be calculated

virtual

Initialize the kernel.

Parameters

system	the System this kernel will be applied to
force	the DensityForce this kernel will be used for

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