Uses of Package
ffx.potential.openmm
Packages that use ffx.potential.openmm
Package
Description
The Optimize package contains local and global optimization algorithms using pure Java and OpenMM
code paths.
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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Classes in ffx.potential.openmm used by ffx.algorithms.optimize
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Classes in ffx.potential.openmm used by ffx.potential.openmmClassDescriptionAmoebaCavitationForce.AmoebaMultipoleForce.OpenMM TorsionTorsion Force.The Amoeba vdW Force.OpenMM Angle Force.OpenMM Angle-Torsion Force.Bond Force.OpenMM Custom MTS Integrator.OpenMM Custom MTS Langevin Integrator.Fixed Charge Alchemical Forces.FixedChargeGBForce.Define a fixed charge non-bonded force.OpenMM Improper Torsion Force.OpenMM In-Plane Angle Force.Creates and manage an OpenMM Context.Compute the potential energy and derivatives using OpenMM.An interface for classes that provide an OpenMM potential energy implementation.Retrieve state information from an OpenMM Simulation.Create and manage an OpenMM System.OpenMM Out-of-Plane Bend Force.OpenMM Pi-Orbital Torsion Force.Restrain Groups Force.Restrain Positions Force.Restrain Torsions Force.OpenMM Stretch-Bend Force.OpenMM Stretch-Torsion Force.Torsion Force.Urey-Bradley Force.