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Large-Scale Virtual Screening for the Discovery of SARS-CoV-2 Papain-like Protease (PLpro) Non-covalent Inhibitors.

Olivia GarlandAnh-Tien TonShoeib MoradiJason R. SmithSuzana KovacicKurtis NgMohit PandeyFuqiang BanJaeyong LeeMarija VuckovicLiam J. WorrallRobert N. YoungRalph PantophletNatalie C. J. StrynadkaArtem Cherkasov
Published in: J. Chem. Inf. Model. (2023)
Keyphrases
  • virtual screening
  • human immunodeficiency virus
  • hiv protease
  • chemical structures
  • drug discovery
  • drug resistance
  • data mining
  • discovery process
  • real world
  • similarity searching
  • database systems
  • high throughput