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Improving the LIE Method for Binding Free Energy Calculations of Protein-Ligand Complexes.

Williams E. MirandaSergei Yu NoskovPedro A. Valiente
Published in: J. Chem. Inf. Model. (2015)
Keyphrases
  • objective function
  • dynamic programming
  • higher order
  • bayesian networks
  • probabilistic model
  • image registration
  • mutual information
  • unsupervised learning