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Combining Horizontal and Vertical Substructure Relationships in Scaffold Hierarchies for Activity Prediction.

Ye HuJürgen Bajorath
Published in: J. Chem. Inf. Model. (2011)
Keyphrases
  • prediction accuracy
  • knowledge building
  • website
  • three dimensional
  • multiscale
  • prediction model
  • prediction error
  • semantic relationships
  • prediction algorithm