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Neural-Network Scoring Functions Identify Structurally Novel Estrogen-Receptor Ligands.

Jacob D. DurrantKathryn E. CarlsonTeresa A. MartinTavina L. OffuttChristopher G. MayneJohn A. KatzenellenbogenRommie E. Amaro
Published in: J. Chem. Inf. Model. (2015)
Keyphrases
  • scoring functions
  • neural network
  • artificial neural networks
  • scoring function
  • similarity measure
  • reinforcement learning
  • information extraction
  • higher order
  • breast cancer