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Calculation of binding free energies of inhibitors to plasmepsin II.

Denise SteinerChris OostenbrinkFrançois DiederichMartina ZürcherWilfred F. van Gunsteren
Published in: J. Comput. Chem. (2011)
Keyphrases
  • hiv protease
  • higher order
  • graph cuts
  • markov random field
  • energy minimization
  • calculation method
  • data sets
  • binding peptides
  • real time
  • learning algorithm
  • image processing
  • high level
  • human immunodeficiency virus