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A Machine Learning-Based Method To Improve Docking Scoring Functions and Its Application to Drug Repurposing.

Sarah L. KinningsNina LiuPeter J. TongeRichard M. JacksonLei XiePhilip E. Bourne
Published in: J. Chem. Inf. Model. (2011)
Keyphrases
  • machine learning
  • pairwise
  • prior knowledge
  • scoring functions
  • support vector machine
  • unsupervised learning
  • energy function
  • machine learning methods