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Virtual screening for plant PARP inhibitors - what can be learned from human PARP inhibitors?

Peter-Paul HeymWolfgang BrandtLudger A. WessjohannHans-Joachim Niclas
Published in: J. Cheminformatics (2012)
Keyphrases
  • computer simulation
  • virtual screening
  • drug discovery
  • similarity measure
  • early stage
  • computational models
  • protein protein interactions
  • similarity searching
  • chemical structures
  • data structure