OpenMD::QuarticBendType Class Reference

#include <QuarticBendType.hpp>

Inheritance diagram for OpenMD::QuarticBendType:

Public Member Functions
	QuarticBendType (RealType r0, RealType k4, RealType k3, RealType k2, RealType k1, RealType k0)
void	setForceConstant (RealType k4, RealType k3, RealType k2, RealType k1, RealType k0)
void	getForceConstant (RealType &k4, RealType &k3, RealType &k2, RealType &k1, RealType &k0)
virtual void	calcForce (RealType theta, RealType &V, RealType &dVdTheta)
Public Member Functions inherited from OpenMD::BendType
	BendType (RealType theta)
RealType	getTheta ()
void	setTheta (RealType theta)

Additional Inherited Members
Protected Attributes inherited from OpenMD::BendType
RealType	theta0_

Detailed Description

Todo

document

Definition at line 62 of file QuarticBendType.hpp.

Constructor & Destructor Documentation

QuarticBendType()

OpenMD::QuarticBendType::QuarticBendType ( RealType r0, RealType k4, RealType k3, RealType k2, RealType k1, RealType k0 )

inline

Definition at line 64 of file QuarticBendType.hpp.

Member Function Documentation

calcForce()

virtual void OpenMD::QuarticBendType::calcForce ( RealType theta, RealType & V, RealType & dVdTheta )

inlinevirtual

Implements OpenMD::BendType.

Definition at line 87 of file QuarticBendType.hpp.

getForceConstant()

void OpenMD::QuarticBendType::getForceConstant ( RealType & k4, RealType & k3, RealType & k2, RealType & k1, RealType & k0 )

inline

Definition at line 78 of file QuarticBendType.hpp.

setForceConstant()

void OpenMD::QuarticBendType::setForceConstant ( RealType k4, RealType k3, RealType k2, RealType k1, RealType k0 )

inline

Definition at line 69 of file QuarticBendType.hpp.

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

• types/QuarticBendType.hpp