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Molecular surface point environments for virtual screening and the elucidation of binding patterns (MOLPRINT).

Andreas BenderHamse Y. MussaGurprem S. GillRobert C. Glen
Published in: SMC (5) (2004)
Keyphrases
  • virtual screening
  • drug discovery
  • similarity searching
  • chemical structures
  • chemical compounds
  • high throughput
  • binding sites
  • scoring function
  • pattern mining
  • databases