Uses of Class
ffx.potential.terms.PiOrbitalTorsionPotentialEnergy
Packages that use PiOrbitalTorsionPotentialEnergy
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.
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Uses of PiOrbitalTorsionPotentialEnergy in ffx.potential
Methods in ffx.potential that return PiOrbitalTorsionPotentialEnergyModifier and TypeMethodDescriptionForceFieldEnergy.getPiOrbitalTorsionPotentialEnergy()
Get the PiOrbitalTorsionPotentialEnergy. -
Uses of PiOrbitalTorsionPotentialEnergy in ffx.potential.openmm
Constructors in ffx.potential.openmm with parameters of type PiOrbitalTorsionPotentialEnergyModifierConstructorDescriptionPiOrbitalTorsionForce
(PiOrbitalTorsionPotentialEnergy piOrbitalTorsionPotentialEnergy) Create a Pi-Orbital Torsion Force.PiOrbitalTorsionForce
(PiOrbitalTorsionPotentialEnergy piOrbitalTorsionPotentialEnergy, int topology, OpenMMDualTopologyEnergy openMMDualTopologyEnergy) Create an Pi-Orbital Torsion Force for Dual Topology.