Package org.openscience.cdk.smsd.interfaces

Interface IFinalMapping

All Known Implementing Classes:
FinalMappings
@Deprecated public interface IFinalMapping
Deprecated.
SMSD has been deprecated from the CDK with a newer, more recent version of SMSD is available at http://github.com/asad/smsd.
Interface for mappings.
Author:
Syed Asad Rahman <asad@ebi.ac.uk>
Source code:
main
Belongs to CDK module:
smsd

  • Method Details

    • add

      void add(Map<Integer,Integer> mapping)
      Deprecated.
      Adds mapping to the mapping list
      Parameters:
      mapping - List of all MCS mapping between a given reactant and product

    • set

      void set(List<Map<Integer,Integer>> list)
      Deprecated.
      Sets mapping list
      Parameters:
      list - List of all MCS mapping between a given reactant and product

    • getIterator

      Iterator<Map<Integer,Integer>> getIterator()
      Deprecated.
      Returns a mapping Iterator
      Returns:
      Iterator of mappings

    • clear

      void clear()
      Deprecated.
      clear the mapping

    • getFinalMapping

      List<Map<Integer,Integer>> getFinalMapping()
      Deprecated.
      Returns the stored mappings
      Returns:
      get of MCS mapping List

    • getSize

      int getSize()
      Deprecated.
      Returns number of stored mappings
      Returns:
      size of the mapping