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Exploring drug space with ChemMaps.com

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1 Published in 2018 at "Bioinformatics"

DOI: 10.1093/bioinformatics/bty412

Abstract: Motivation: Easily navigating chemical space has become more important due to the increasing size and diversity of publicly‐accessible databases such as DrugBank, ChEMBL or Tox21. To do so, modelers typically rely on complex projection techniques… read more here.

Keywords: drug space; exploring drug; space; chemmaps com ... See more keywords