Package org.openscience.cdk.group

Interface Summary

Interface	Description
AtomContainerDiscretePartitionRefiner	A tool for determining the automorphism group of the atoms in a molecule, or for checking for a canonical form of a molecule.
DiscretePartitionRefiner	A mechanism for refining partitions of graph-like objects.
Invariant	Marker interface for invariants.
PermutationGroup.Backtracker	An interface for use with the apply method, which runs through all the permutations in this group.
Refinable	Implementors are graph-like objects that are refinable by the equitable and discrete partition refiners.

Class Summary

Class	Description
DisjointSetForest	Implementation of a union-find data structure, largely copied from code due to Derrick Stolee.
Partition	A partition of a set of integers, such as the discrete partition {{1}, {2}, {3}, {4}} or the unit partition {{1, 2, 3, 4}} or an intermediate like {{1, 2}, {3, 4}}.
PartitionRefinement	Factory for partition refiners.
PartitionRefinement.AtomRefinerBuilder
PartitionRefinement.BondRefinerBuilder
Permutation	A permutation with some associated methods to multiply, invert, and convert to cycle strings.
PermutationGroup	A permutation group with a Schreier-Sims representation.