Thinklab UniChem: extension of InChI-based compound mapping to salt, connectivity and stereochemistry layers followers

EXTERNAL PUBLICATION

UniChem: extension of InChI-based compound mapping to salt, connectivity and stereochemistry layers

Jon Chambers, Mark Davies, Anna Gaulton, George Papadatos, Anne Hersey, John P Overington

Jan. 1, 2014 Journal of Cheminformatics

DOI: 10.1186/s13321-014-0043-5