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Overview of the SAMPL6 host-guest binding affinity prediction challenge.

Andrea RizziSteven MurkliJohn N. McNeillWei YaoMatthew R. SullivanMichael K. GilsonMichael ChiuLyle IsaacsBruce C. GibbDavid L. MobleyJohn D. Chodera
Published in: J. Comput. Aided Mol. Des. (2018)
Keyphrases
  • prediction accuracy
  • prediction error
  • pairwise
  • multi agent
  • prediction model
  • real time
  • stream data mining
  • data sets
  • genetic algorithm
  • computer systems
  • video coding
  • prediction algorithm