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KCF-S: KEGG Chemical Function and Substructure for improved interpretability and prediction in chemical bioinformatics.

Masaaki KoteraYasuo TabeiYoshihiro YamanishiYuki MoriyaToshiaki TokimatsuMinoru KanehisaSusumu Goto
Published in: BMC Syst. Biol. (2013)
Keyphrases
  • prediction accuracy
  • drug discovery
  • data mining
  • machine learning
  • prediction model
  • drug design
  • genetic algorithm
  • data analysis
  • high throughput
  • rule base
  • chemical compounds
  • chemical engineering