MACCS-166 fingerprint

    This page is about ChemAxon's implementation of the MACCS-166 fingerprint. Some details of the implementation can be found here.

    Availability

    API

    The API documentation page of the ChemAxon MACCS-166 fingerprint implementation can be found here.

    KNIME

    The MACCS-166 fingerprint is available as a JChem KNIME node as well. Its documentation can be found here.

    References

    Roger Sayle, "Efficient simultaneous matching of multiple SMARTS using the ChemAxon toolkits" (lecture, 2011 ChemAxon US UGM, San Diego, USA, 28th Sept 2011)