Articles with "drugscore2018" as a keyword



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Converging a Knowledge-Based Scoring Function: DrugScore2018

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Published in 2019 at "Journal of chemical information and modeling"

DOI: 10.1021/acs.jcim.8b00582

Abstract: We present DrugScore2018, a new version of the knowledge-based scoring function DrugScore, which builds upon the same formalism used to derive DrugScore but exploits a training data set of nearly 40 000 X-ray complex structures, a… read more here.

Keywords: knowledge based; based scoring; scoring function; drugscore2018 ... See more keywords