Open davidlmobley opened 7 years ago
OpenEye suggested a solution to flag molecules which potentially have multiple relevant tautomers. We ought to do this, or something similar, and at least flag such molecules, or possibly investigate them further via alternate tools such as Epik.
Epik
https://www.evernote.com/l/ABpN_7k6J4hPG4Ye4o06M7RKtc_ad4YKHJE
OpenEye suggested a solution to flag molecules which potentially have multiple relevant tautomers. We ought to do this, or something similar, and at least flag such molecules, or possibly investigate them further via alternate tools such as
Epik.https://www.evernote.com/l/ABpN_7k6J4hPG4Ye4o06M7RKtc_ad4YKHJE