Hi - A RDKit-based implementation of the QED measure as described by Richard Bickerton (Nature Chemistry, 2012, 4, 90-98) has been implemented and made available for download from our website ( www.silicos-it.com > Biscu-it). Regards, - Hans  www.silicos-it.com A division of Imacosi bvba De Roskam 35, 2970 Schilde Belgium |
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