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Hierarchical PLS Modeling for Predicting the Binding of a Comprehensive Set of Structurally Diverse Protein-Ligand Complexes.

Anton LindströmFredrik PetterssonFredrik AlmqvistAnders BerglundJan KihlbergAnna Linusson
Published in: J. Chem. Inf. Model. (2006)
Keyphrases
  • comprehensive set
  • drug design
  • partial least squares
  • drug discovery
  • protein complexes
  • predicting protein
  • protein protein
  • sequence analysis
  • dna binding
  • virtual screening