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Biomacromolecular quantitative structure-activity relationship (BioQSAR): a proof-of-concept study on the modeling, prediction and interpretation of protein-protein binding affinity.

Peng ZhouCongcong WangFeifei TianYanrong RenChao YangJian Huang
Published in: J. Comput. Aided Mol. Des. (2013)
Keyphrases
  • drug design
  • quantitative structure activity
  • fine grained
  • protein structure prediction
  • databases
  • complex systems
  • reverse engineering