Uses of Class
ffx.potential.parameters.AngleType
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.
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Uses of AngleType in ffx.potential.bonded
Modifier and TypeFieldDescriptionAngle.angleType
Force field parameters to compute the angle bending energy.AngleTorsion.angleType1
First angle force field type.AngleTorsion.angleType2
Second angle force field type.Modifier and TypeMethodDescriptionvoid
Angle.setAngleType
(AngleType a) Set a reference to the force field parameters for this Angle. -
Uses of AngleType in ffx.potential.parameters
Modifier and TypeMethodDescriptionstatic AngleType
Average two AngleType instances.ForceField.getAngleType
(AtomType a1, AtomType a2, AtomType a3) getAngleTypeForceField.getAngleType
(String key) getAngleTypestatic AngleType
Construct an AngleType from an input string.static AngleType
AngleType.parseInPlane
(String input, String[] tokens) Construct an In-Plane AngleType from an input string.AngleType.patchClasses
(HashMap<AtomType, AtomType> typeMap) Remap new atom classes to known internal ones.Modifier and TypeMethodDescriptionForceField.getAnglepTypes()
ForceField.getAngleTypes()
Get AngleTypes.