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A 3D-QSAR-Driven Approach to Binding Mode and Affinity Prediction.

Paolo ToscoThomas Balle
Published in: J. Chem. Inf. Model. (2012)
Keyphrases
  • prediction accuracy
  • drug design
  • data driven
  • prediction algorithm
  • pairwise
  • prediction model
  • decision trees
  • real time
  • real world
  • data streams
  • early stage
  • prediction error
  • drug discovery