Uses of Enum Class
org.openscience.cdk.interfaces.ITetrahedralChirality.Stereo
Packages that use ITetrahedralChirality.Stereo
Package
Description
-
Uses of ITetrahedralChirality.Stereo in org.openscience.cdk.geometry.cip
Methods in org.openscience.cdk.geometry.cip with parameters of type ITetrahedralChirality.StereoModifier and TypeMethodDescriptionstatic org.openscience.cdk.geometry.cip.LigancyFourChiralityCIPTool.defineLigancyFourChirality(IAtomContainer container, int chiralAtom, int ligand1, int ligand2, int ligand3, int ligand4, ITetrahedralChirality.Stereo stereo) Creates a ligancy for chirality around a single chiral atom, where the involved atoms are identified by there index in theIAtomContainer. -
Uses of ITetrahedralChirality.Stereo in org.openscience.cdk.interfaces
Methods in org.openscience.cdk.interfaces that return ITetrahedralChirality.StereoModifier and TypeMethodDescriptionITetrahedralChirality.getStereo()Defines the stereochemistry around the chiral atom.ITetrahedralChirality.Stereo.invert()Invert this conformation, inv(clockwise) = anti_clockwise, inv(anti_clockwise) = clockwise.static ITetrahedralChirality.StereoITetrahedralChirality.Stereo.toStereo(int cfg) static ITetrahedralChirality.StereoReturns the enum constant of this class with the specified name.static ITetrahedralChirality.Stereo[]ITetrahedralChirality.Stereo.values()Returns an array containing the constants of this enum class, in the order they are declared.Methods in org.openscience.cdk.interfaces with parameters of type ITetrahedralChirality.StereoModifier and TypeMethodDescriptionvoidITetrahedralChirality.setStereo(ITetrahedralChirality.Stereo stereo) Set the stereochemistry of this tetrahedral centre.static intITetrahedralChirality.Stereo.toConfig(ITetrahedralChirality.Stereo stereo) -
Uses of ITetrahedralChirality.Stereo in org.openscience.cdk.stereo
Methods in org.openscience.cdk.stereo that return ITetrahedralChirality.StereoModifier and TypeMethodDescriptionstatic ITetrahedralChirality.StereoTake four atoms, and return Stereo.CLOCKWISE or Stereo.ANTI_CLOCKWISE.TetrahedralChirality.getStereo()ExtendedTetrahedral.winding()The winding of the peripherals, when viewed from the first atom.Methods in org.openscience.cdk.stereo with parameters of type ITetrahedralChirality.StereoModifier and TypeMethodDescriptionvoidTetrahedralChirality.setStereo(ITetrahedralChirality.Stereo stereo) Constructors in org.openscience.cdk.stereo with parameters of type ITetrahedralChirality.StereoModifierConstructorDescriptionExtendedTetrahedral(IAtom focus, IAtom[] peripherals, ITetrahedralChirality.Stereo winding) Create an extended tetrahedral stereo element for the provided 'focus' and 'peripherals' in the given 'winding'.TetrahedralChirality(IAtom chiralAtom, IAtom[] ligands, ITetrahedralChirality.Stereo stereo)