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NNScore 2.0: A Neural-Network Receptor-Ligand Scoring Function.

Jacob D. DurrantJames Andrew McCammon
Published in: J. Chem. Inf. Model. (2011)
Keyphrases
  • scoring function
  • neural network
  • virtual screening
  • drug discovery
  • scoring functions
  • structure learning
  • ranking functions
  • decision trees
  • active learning
  • biological systems