Uses of Class
ffx.potential.parameters.BondType
Package
Description
The Bonded package implements bonded molecular mechanics terms such as bonds, angles, torsions,
etc.
The Parameters package stores force field atom types, bond types, etc, and keywords that define
the potential.
-
Uses of BondType in ffx.potential.bonded
Modifier and TypeFieldDescriptionBond.bondType
The force field BondType for this bond.RestrainDistance.bondType
StretchTorsion.bondType1
First bond force field type.StretchTorsion.bondType2
Second bond force field type.StretchTorsion.bondType3
Third bond force field type.Modifier and TypeMethodDescriptionBond.getBondType()
Return the BondType for this Bond.RestrainDistance.getBondType()
Getter for the fieldbondType
.Modifier and TypeMethodDescriptionvoid
Bond.setBondType
(BondType bondType) Set a reference to the force field parameters.void
RestrainDistance.setBondType
(BondType bondType) Set a reference to the force field parameters. -
Uses of BondType in ffx.potential.parameters
Modifier and TypeMethodDescriptionstatic BondType
Average two BondType instances.ForceField.getBondType
(AtomType a1, AtomType a2) getBondTypeForceField.getBondType
(String key) getBondTypestatic BondType
Construct a BondType from an input string.BondType.patchClasses
(HashMap<AtomType, AtomType> typeMap) Remap new atom classes to known internal ones.