reviewNature ProtocolsFeb 4, 2022BRONZE OA

Artificial intelligence–enabled virtual screening of ultra-large chemical libraries with deep docking

FGFrancesco GentileJCJean Charle YaacoubJGJames GleaveMFMichael FernándezATAnh‐Tien Ton

University of British Columbia · Nvidia (United States) · +1 more institution

PubMed
Indexed incrossrefpubmed

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380
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Authors

8

Topics & keywords

Topics
Keywords
  • Virtual screening
  • Computer science
  • Workflow
  • Chemical database
  • Docking (animal)
  • Drug discovery
  • Bioinformatics
  • Database
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