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Incorporating the effect of ionic strength in free energy calculations using explicit ions.

Serena DonniniAlan E. MarkAndré H. JufferAlessandra Villa
Published in: J. Comput. Chem. (2005)
Keyphrases
  • free energy
  • belief propagation
  • fixed point
  • upper bound
  • competitive learning
  • machine learning
  • graphical models
  • posterior distribution
  • approximate inference
  • neural network
  • least squares