Discover and read the best of Twitter Threads about #ACSCINF

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#ACSCINF Marcel Verdonk (of Astex) about to speak on Artificial Intelligence for predicting Molecular Electrostatic Properties
#ACSCINF My question: Have you looked at density difference maps and maybe there's a way to correct systematic errors. Answer: that's basically what we were doing. Though not very systematically, but to identify problems - not sure if it might be possible.
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#ACSCINF Jurgen Bajorath on progression saturation analysis of analog series using virtual candidate cmpds
#ACSCINF Evolving analog series. Very few large series present in ChEMBL, 100+ analogs. We model an evolving series.
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