Files
rdkit/Code/GraphMol/QueryOps.cpp
Brian Kelley 7a8df171d0 RDKit learns how to query properties on Atoms
Examples:

    QueryAtom qA;
    qA.setQuery(makeAtomHasPropQuery("foo"));

    QueryAtom qA;
    qA.setQuery(makeAtomPropQuery<double>("foo", 2));

    QueryAtom qA;
    qA.setQuery(makeAtomPropQuery<std::string>("foo", "bar"));
2015-02-25 15:28:34 -05:00

9.9 KiB