Package org.openscience.cdk.geometry.cip
-
Interface Summary Interface Description ILigand Concept of a ligand in CIP terms, reflecting a side chain of a central atom that can have precedence over another. -
Class Summary Class Description CIPTool Tool to help determine the R,S and stereochemistry definitions of a subset of the CIP rules [Cahn, R.S. et. al.. Angew. Chem. Int. Ed.. 1966. 5].ImplicitHydrogenLigand Subclass ofLigand
to which no further recursion must be applied.Ligand Concept of a ligand in CIP terms, reflecting a side chain of a central atom that can have precedence over another.VisitedAtoms Helper class for theCIPTool
to keep track of which atoms have already been visited. -
Enum Summary Enum Description CIPTool.CIP_CHIRALITY Enumeration with the two tetrahedral chiralities defined by the CIP schema.