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Improving the Odds in Discriminating "Drug-like" from "Non Drug-like" Compounds.

Thomas M. FrimurerRobert BywaterLars NærumLeif Nørskov LauritsenSøren Brunak
Published in: J. Chem. Inf. Comput. Sci. (2000)
Keyphrases
  • drug discovery
  • chemical compounds
  • data mining
  • artificial intelligence
  • drug design
  • virtual screening
  • database
  • case study
  • probabilistic model
  • clinical trials
  • discriminating features