Uses of Class
ffx.openmm.IntArray
Packages that use IntArray
Package
Description
The OpenMM package includes Java classes that are analogues of the OpenMM C++ API.
The AMOEBA package includes Java classes that are analogues of the OpenMM C++ API
for the AMOEBA model.
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Uses of IntArray in ffx.openmm
Methods in ffx.openmm with parameters of type IntArrayModifier and TypeMethodDescriptionint
CustomCentroidBondForce.addBond
(IntArray groups, DoubleArray parameters) Add a bond to the forceint
CustomCompoundBondForce.addBond
(IntArray particles, DoubleArray parameters) Add a bond to the force.int
CustomCentroidBondForce.addGroup
(IntArray particles, DoubleArray weights) Add a particle group.void
CustomCentroidBondForce.getBondParameters
(int index, IntArray groups, DoubleArray parameters) Get the properties of a bond.void
CustomCompoundBondForce.getBondParameters
(int index, IntArray particles, DoubleArray parameters) Get the parameters for a bond.void
CustomCentroidBondForce.getGroupParameters
(int index, IntArray particles, DoubleArray weights) Get the properties of a group.void
CustomCentroidBondForce.setBondParameters
(int index, IntArray groups, DoubleArray parameters) Set the properties of a bond.void
CustomCompoundBondForce.setBondParameters
(int index, IntArray particles, DoubleArray parameters) Set the parameters for a bond.void
CustomCentroidBondForce.setGroupParameters
(int index, IntArray particles, DoubleArray weights) Set the properties of a group. -
Uses of IntArray in ffx.openmm.amoeba
Methods in ffx.openmm.amoeba that return IntArrayModifier and TypeMethodDescriptionMultipoleForce.getCovalentMap
(int i, int covalentType) Get the covalent map for a given atom index and covalent type.MultipoleForce.getCovalentMaps
(int i) Get all covalent maps for a given atom index.VdwForce.getParticleExclusions
(int i) Get the particle exclusions.MultipoleForce.getPmeGridDimensions()
Get the PME grid dimensions.Methods in ffx.openmm.amoeba with parameters of type IntArrayModifier and TypeMethodDescriptionvoid
MultipoleForce.setCovalentMap
(int i, int covalentType, IntArray covalentMap) Set the covalent map.void
VdwForce.setParticleExclusions
(int i, IntArray exclusions) Set the particle exclusions.void
MultipoleForce.setPmeGridDimensions
(IntArray gridDimensions) Set the PME grid dimensions for the multipole force.