Uses of Package
ffx.potential.terms
Packages that use ffx.potential.terms
Package
Description
The Potential package implements molecular mechanics force fields with shared memory Parallel
Java and via OpenMM.
The openmm package contains utilities to construct and run Force Field X
potentials on the OpenMM platform, including system builders, custom forces,
alchemical fixed-charge forces, and integrators tailored to FFX simulations.
The terms package contains analytical potential energy terms and their
gradients for bonded interactions (bond, angle, stretch-bend, torsions,
impropers, Urey-Bradley) and restraint terms used by Force Field X.
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Classes in ffx.potential.terms used by ffx.potentialClassDescriptionAngle potential energy term using
Angle
instances.Angle-Torsion potential energy term usingAngleTorsion
instances.Bond potential energy term usingBond
instances.Improper Torsion potential energy term usingImproperTorsion
instances.Out-of-Plane Bend potential energy term usingOutOfPlaneBend
instances.Pi-Orbital Torsion potential energy term usingPiOrbitalTorsion
instances.Restrain-Distance potential energy term usingRestrainDistance
instances.Restrain-Position potential energy term usingRestrainPosition
instances.Restrain-Torsion potential energy term usingTorsion
instances.Stretch-Bend potential energy term usingStretchBend
instances.Stretch-Torsion potential energy term usingStretchTorsion
instances.Torsion potential energy term usingTorsion
instances.Torsion-Torsion potential energy term usingTorsionTorsion
instances.Urey-Bradley potential energy term usingUreyBradley
instances. -
Classes in ffx.potential.terms used by ffx.potential.openmmClassDescriptionAngle potential energy term using
Angle
instances.Angle-Torsion potential energy term usingAngleTorsion
instances.Bond potential energy term usingBond
instances.Improper Torsion potential energy term usingImproperTorsion
instances.Out-of-Plane Bend potential energy term usingOutOfPlaneBend
instances.Pi-Orbital Torsion potential energy term usingPiOrbitalTorsion
instances.Restrain-Distance potential energy term usingRestrainDistance
instances.Restrain-Position potential energy term usingRestrainPosition
instances.Restrain-Torsion potential energy term usingTorsion
instances.Stretch-Bend potential energy term usingStretchBend
instances.Stretch-Torsion potential energy term usingStretchTorsion
instances.Torsion potential energy term usingTorsion
instances.Torsion-Torsion potential energy term usingTorsionTorsion
instances.Urey-Bradley potential energy term usingUreyBradley
instances. -
Classes in ffx.potential.terms used by ffx.potential.terms