Class QueryCompiler

  • All Implemented Interfaces:
    IQueryCompiler

    @Deprecated
    public class QueryCompiler
    extends Object
    implements IQueryCompiler
    Deprecated.
    SMSD has been deprecated from the CDK with a newer, more recent version of SMSD is available at http://github.com/asad/smsd.
    This class creates an template for MCS/substructure query.
    Author:
    Syed Asad Rahman <asad@ebi.ac.uk>
    Source code:
    main
    Belongs to CDK module:
    smsd
    • Constructor Detail

      • QueryCompiler

        public QueryCompiler​(IAtomContainer molecule,
                             boolean shouldMatchBonds)
        Deprecated.
        Construct query object from the molecule
        Parameters:
        molecule -
        shouldMatchBonds -
      • QueryCompiler

        public QueryCompiler​(IQueryAtomContainer molecule)
        Deprecated.
        Construct query object from the molecule
        Parameters:
        molecule -
    • Method Detail

      • compile

        public IQuery compile()
        Deprecated.
        Parse and build a query graph from the query moleucle.
        Specified by:
        compile in interface IQueryCompiler
        Returns:
        compile the query molecule and build the graph.