Class SimpleAtomComparator

java.lang.Object
org.openscience.cdk.fingerprint.SimpleAtomComparator
All Implemented Interfaces:
Serializable, Comparator<IAtom>

public class SimpleAtomComparator extends Object implements Comparator<IAtom>, Serializable

This code returns a sorted set of atoms for a container according to its symbol and hybridization states. This will aid in finding a deterministic path rather than Stochastic one.

Author:
Syed Asad Rahman (2012)
See Also:
Source code:
main
Belongs to CDK module:
fingerprint
Keywords:
fingerprint, similarity
  • Constructor Details

    • SimpleAtomComparator

      public SimpleAtomComparator()
  • Method Details