Uses of Class
ffx.potential.nonbonded.CoordRestraint

Packages that use CoordRestraint

Package	Description
ffx.potential	The Potential package implements molecular mechanics force fields with shared memory Parallel Java and via OpenMM.
ffx.potential.parsers	The Parsers package handles reading/writing files to/from the internal data structure.

Uses of CoordRestraint in ffx.potential

Methods in ffx.potential that return types with arguments of type CoordRestraint

Modifier and Type	Method	Description
List<CoordRestraint>	ForceFieldEnergy.getCoordRestraints()	Getter for the field coordRestraints.

Method parameters in ffx.potential with type arguments of type CoordRestraint

Modifier and Type	Method	Description
static ForceFieldEnergy	ForceFieldEnergy.energyFactory(MolecularAssembly assembly, List<CoordRestraint> restraints)	Static factory method to create a ForceFieldEnergy, possibly via FFX or OpenMM implementations.
static ForceFieldEnergy	ForceFieldEnergy.energyFactory(MolecularAssembly assembly, List<CoordRestraint> restraints, int numThreads)	Static factory method to create a ForceFieldEnergy, possibly via FFX or OpenMM implementations.

Constructor parameters in ffx.potential with type arguments of type CoordRestraint

Modifier	Constructor	Description
protected	ForceFieldEnergy(MolecularAssembly molecularAssembly, List<CoordRestraint> restraints)	Constructor for ForceFieldEnergy.
protected	ForceFieldEnergy(MolecularAssembly molecularAssembly, List<CoordRestraint> restraints, int numThreads)	Constructor for ForceFieldEnergy.
protected	ForceFieldEnergyOpenMM(MolecularAssembly molecularAssembly, ForceFieldEnergy.Platform requestedPlatform, List<CoordRestraint> restraints, int nThreads)	ForceFieldEnergyOpenMM constructor; offloads heavy-duty computation to an OpenMM Platform while keeping track of information locally.

Uses of CoordRestraint in ffx.potential.parsers

Methods in ffx.potential.parsers that return types with arguments of type CoordRestraint

Modifier and Type	Method	Description
List<CoordRestraint>	SystemFilter.getCoordRestraints()	Gets the coordinate restraints parsed by this Filter.