A highly efficient hybrid method for calculating the hydration free energy of a protein.

Hiraku Oshima Masahiro Kinoshita

Published in: J. Comput. Chem. (2016)

Keyphrases

highly efficient
hybrid method
free energy
belief propagation
competitive learning
upper bound
fixed point
posterior distribution
hybrid algorithm
support vector machine
graphical models
low cost
approximate inference
low complexity
latent variables
optimization method
lower bound