Login / Signup
Assessment of Binding Affinity via Alchemical Free-Energy Calculations.
Maximilian Kuhn
Stuart Firth-Clark
Paolo Tosco
Antonia S. J. S. Mey
Mark Mackey
Julien Michel
Published in:
J. Chem. Inf. Model. (2020)
Keyphrases
</>
free energy
belief propagation
fixed point
competitive learning
posterior distribution
upper bound
pairwise
generalized belief propagation
energy minimization
graphical models
high quality
stereo matching
information theoretic
active contours
approximate inference
least squares
dynamic programming