Uses of Class
ffx.potential.bonded.BondedTerm
Packages that use BondedTerm
Package
Description
The Bonded package implements bonded molecular mechanics terms such as bonds, angles, torsions,
 etc.
The terms package contains analytical potential energy terms and their
 gradients for bonded interactions (bond, angle, stretch-bend, torsions,
 impropers, Urey-Bradley) and restraint terms used by Force Field X.
- 
Uses of BondedTerm in ffx.potential.bonded
Subclasses of BondedTerm in ffx.potential.bondedModifier and TypeClassDescriptionclassThe Angle class represents an angle formed between three linearly bonded atoms.classThe AngleTorsion class represents an angle torsion coupling between four bonded atoms.classThe Bond class represents a covalent bond formed between two atoms.classThe ImproperTorsion class represents an Improper Torsion.classThe OutOfPlaneBend class represents an Out-Of-Plane Bend.classThe Pi-Orbital Torsion class.classRestraintDistance class.classRestrain the position of atoms to their initial coordinates.classRestraintTorsion is a class that restrains the torsion angle defined by four atoms.classThe StretchBend class represents a Stretch-Bend formed between three linearly bonded atoms.classThe StretchTorsion class represents a coupling between a torsional angle and the three bonds contained in the torsion, as defined in the 2017 AMOEBA nucleic acid force field.classThe Torsion class represents a torsional angle formed between four bonded atoms.classThe TorsionTorsion class represents two adjacent torsional angles formed by five bonded atoms.classThe UreyBradley class.Methods in ffx.potential.bonded with type parameters of type BondedTermModifier and TypeMethodDescriptionstatic <T extends BondedTerm>
voidBondedTerm.removeNeuralNetworkTerms(List<T> list) This method removes terms from a list that are marked as being part of a neural network.Methods in ffx.potential.bonded with parameters of type BondedTermModifier and TypeMethodDescriptionintBondedTerm.BondedComparator.compare(BondedTerm bondedTerm1, BondedTerm bondedTerm2) Sort using position in the naturalOrder list; fallback to alphabetical.intAngle.compareTo(BondedTerm a) intBond.compareTo(BondedTerm b) intBondedTerm.compareTo(BondedTerm t) intImproperTorsion.compareTo(BondedTerm o) intOutOfPlaneBend.compareTo(BondedTerm o) intStretchBend.compareTo(BondedTerm sb) intUreyBradley.compareTo(BondedTerm ub)  - 
Uses of BondedTerm in ffx.potential.terms
Methods in ffx.potential.terms that return BondedTermModifier and TypeMethodDescriptionAnglePotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.AngleTorsionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.BondPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.abstract BondedTerm[]EnergyTerm.getBondedTermsArray()Get an array of BondedTerms in this term.ImproperTorsionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.OutOfPlaneBendPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.PiOrbitalTorsionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.RestrainDistancePotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.RestrainPositionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.RestrainTorsionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.StretchBendPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.StretchTorsionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.TorsionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.TorsionTorsionPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.UreyBradleyPotentialEnergy.getBondedTermsArray()Get an array of BondedTerms in this term.