Uses of Class
ffx.potential.bonded.ResidueState
Package
Description
The Bonded package implements bonded molecular mechanics terms such as bonds, angles, torsions,
etc.
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Uses of ResidueState in ffx.potential.bonded
Modifier and TypeFieldDescriptionRotamer.originalState
Residue state used to initialize the rotamer.Modifier and TypeMethodDescriptionstatic ResidueState[]
ResidueState.storeAllCoordinates
(Residue[] residues) storeAllCoordinates.static ResidueState[]
ResidueState.storeAllCoordinates
(List<Residue> residueList) storeAllCoordinates.MultiResidue.storeState()
storeState.Residue.storeState()
storeState.Modifier and TypeMethodDescriptiondouble
ResidueState.compareTo
(ResidueState residueState) static void
ResidueState.revertAllCoordinates
(List<Residue> residueList, ResidueState[] states) revertAllCoordinates.void
MultiResidue.revertState
(ResidueState state) void
Residue.revertState
(ResidueState state) revertState.ModifierConstructorDescriptionRotamer
(AminoAcidUtils.AminoAcid3 aminoAcid3, ResidueState residueState, double... values) Constructor for Rotamer.Rotamer
(AminoAcidUtils.AminoAcid3 aminoAcid3, ResidueState residueState, TitrationUtils titrationUtils, double... values) Constructor for Rotamer.Rotamer
(NucleicAcidUtils.NucleicAcid3 nucleicAcid3, ResidueState residueState, double... values) Constructor for Rotamer.Rotamer
(NucleicAcidUtils.NucleicAcid3 nucleicAcid3, ResidueState residueState, TitrationUtils titrationUtils, double... values) Constructor for Rotamer.Rotamer
(ResidueState residueState, double... values) Constructor for unknown residue types.Rotamer
(ResidueState residueState, TitrationUtils titrationUtils, double... values) Constructor for unknown residue types.