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Sampling and refinement protocols for template-based macrocycle docking: 2018 D3R Grand Challenge 4.

Sergei KotelnikovAndrey AlekseenkoCong LiuMikhail IgnatovDzmitry PadhornyEmiliano BriniMark LukinEvangelos A. CoutsiasKen A. DillDima Kozakov
Published in: J. Comput. Aided Mol. Des. (2020)
Keyphrases
  • grand challenge
  • autonomous driving
  • random sampling
  • sampling algorithm
  • sampling strategy
  • sample size
  • grand challenges
  • monte carlo
  • neural network
  • database systems
  • sampling methods
  • communication protocols