Package ffx.openmm.amoeba

@ParametersAreNonnullByDefault package ffx.openmm.amoeba

The AMOEBA package includes Java classes that are analogues of the OpenMM C++ API for the AMOEBA model.

Since:

1.0

Author:

Michael J. Schnieders

Related Packages

Package	Description
ffx.openmm	The OpenMM package includes Java classes that are analogues of the OpenMM C++ API.
ffx.openmm.drude	The Drude package includes Java classes that are analogues of the OpenMM C++ API for the Charmm Drude model.

Classes

Class	Description
DoubleArray3D	DoubleArray3D.
GeneralizedKirkwoodForce	This class implements an implicit solvation force using the Amoeba Generalized Kirkwood model.
GKCavitationForce	Implicit Solvent Cavitation Force.
HippoNonbondedForce	This class implements all nonbonded interactions in the HIPPO force field: electrostatics, induction, charge transfer, dispersion, and repulsion.
MultipoleForce	This class implements the Amoeba multipole interaction.
TorsionTorsionForce	This class implements the Amoeba torsion-torsion interaction.
VdwForce	This class models van der Waals forces in the AMOEBA force field.
WcaDispersionForce	This class implements a nonbonded interaction between pairs of particles typically used along with AmoebaGeneralizedKirkwoodForce as part of an implicit solvent model.