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Fingerprint Scaling Increases the Probability of Identifying Molecules with Similar Activity in Virtual Screening Calculations.

Ling XueFlorence L. StahuraJeffrey W. GoddenJürgen Bajorath
Published in: J. Chem. Inf. Comput. Sci. (2001)
Keyphrases
  • virtual screening
  • drug discovery
  • chemical structures
  • similarity searching
  • high throughput
  • binding sites
  • database
  • metadata
  • similarity search