Package ffx.potential.openmm

Class AmoebaTorsionTorsionForce

java.lang.Object

ffx.openmm.Force

ffx.openmm.amoeba.TorsionTorsionForce

ffx.potential.openmm.AmoebaTorsionTorsionForce

public class AmoebaTorsionTorsionForce
extends TorsionTorsionForce

OpenMM TorsionTorsion Force.

Field Summary

Fields inherited from class ffx.openmm.Force

pointer

Constructor Summary

Constructors

Constructor	Description
AmoebaTorsionTorsionForce(OpenMMEnergy openMMEnergy)	Create an OpenMM TorsionTorsion Force.

Method Summary

Modifier and Type	Method	Description
static Force	constructForce(OpenMMEnergy openMMEnergy)	Convenience method to construct an OpenMM Torsion-Torsion Force.

Methods inherited from class ffx.openmm.amoeba.TorsionTorsionForce

addTorsionTorsion, destroy, setTorsionTorsionGrid

Methods inherited from class ffx.openmm.Force

getForceGroup, getForceIndex, getName, getPointer, setForceGroup, setForceIndex, setName, usesPeriodicBoundaryConditions

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Constructor Details

AmoebaTorsionTorsionForce

public AmoebaTorsionTorsionForce(OpenMMEnergy openMMEnergy)

Create an OpenMM TorsionTorsion Force.

Parameters:

openMMEnergy - The OpenMM Energy instance that contains the torsion-torsions.

Method Details

constructForce

public static Force constructForce(OpenMMEnergy openMMEnergy)

Convenience method to construct an OpenMM Torsion-Torsion Force.

Parameters:

openMMEnergy - The OpenMM Energy instance that contains the torsion-torsions.

Returns:

A Torsion-Torsion Force, or null if there are no torsion-torsions.