When performing free energy calculations using the expanded ensemble
method, there is a barker and metropolis option for lmc-stats. Are the
corresponding transition probabilities computed with or without the
weighting factors? That is, are these probabilities biased or not?
Thank you,
Andrew
--
Andrew S. Paluch, PhD
Department of Chemical, Paper, and Biomedical Engineering
Miami University
paluc...@miamioh.edu
(513) 529-0784
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