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vsFilt: A Tool to Improve Virtual Screening by Structural Filtration of Docking Poses.

Irina V. GushchinaAleksandra M. PolenovaDmitry A. SuplatovVytas K. SvedasDmitry K. Nilov
Published in: J. Chem. Inf. Model. (2020)
Keyphrases
  • drug discovery
  • virtual screening
  • chemical structures
  • data mining
  • bayesian networks
  • data structure
  • low dimensional
  • similarity searching