OpenMD::CubicTorsionType Class Reference

#include <CubicTorsionType.hpp>

Inheritance diagram for OpenMD::CubicTorsionType:

Public Member Functions
	CubicTorsionType (RealType k3, RealType k2, RealType k1, RealType k0)
void	setForceConstant (RealType k3, RealType k2, RealType k1, RealType k0)
void	getForceConstant (RealType &k3, RealType &k2, RealType &k1, RealType &k0)
virtual void	calcForce (RealType cosPhi, RealType &V, RealType &dVdCosPhi)

Detailed Description

Todo

document

Definition at line 62 of file CubicTorsionType.hpp.

Constructor & Destructor Documentation

CubicTorsionType()

OpenMD::CubicTorsionType::CubicTorsionType ( RealType k3, RealType k2, RealType k1, RealType k0 )

inline

Definition at line 64 of file CubicTorsionType.hpp.

Member Function Documentation

calcForce()

virtual void OpenMD::CubicTorsionType::calcForce ( RealType cosPhi, RealType & V, RealType & dVdCosPhi )

inlinevirtual

Implements OpenMD::TorsionType.

Definition at line 82 of file CubicTorsionType.hpp.

getForceConstant()

void OpenMD::CubicTorsionType::getForceConstant ( RealType & k3, RealType & k2, RealType & k1, RealType & k0 )

inline

Definition at line 74 of file CubicTorsionType.hpp.

setForceConstant()

void OpenMD::CubicTorsionType::setForceConstant ( RealType k3, RealType k2, RealType k1, RealType k0 )

inline

Definition at line 67 of file CubicTorsionType.hpp.

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

• types/CubicTorsionType.hpp