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Representation of target-bound drugs by computed conformers: implications for conformational libraries.

Stefan GüntherChristian SengerElke MichalskyAndrean GoedeRobert Preissner
Published in: BMC Bioinform. (2006)
Keyphrases
  • upper bound
  • worst case
  • error bounds
  • lower bound
  • data sets
  • multiscale
  • representation scheme
  • data mining
  • information systems
  • high level
  • database systems
  • feature representation
  • target detection