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TrixX: structure-based molecule indexing for large-scale virtual screening in sublinear time.

Ingo SchellhammerMatthias Rarey
Published in: J. Comput. Aided Mol. Des. (2007)
Keyphrases
  • drug discovery
  • virtual screening
  • real world
  • chemical structures
  • information retrieval
  • data analysis
  • graphical models
  • similarity searching