most citedAI-aided multiscale modeling of physiologically-significant blood clots

6 citations · 10 across the 4 of their papers we have counts for

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cs.LG2020

CASTELO: Clustered Atom Subtypes aidEd Lead Optimization -- a combined machine learning and molecular modeling method

Leili Zhang, Giacomo Domeniconi, Chih-Chieh Yang +3

Drug discovery is a multi-stage process that comprises two costly major steps: pre-clinical research and clinical trials. Among its stages, lead optimization easily consumes more t…