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On the use of mass scaling for stable and efficient simulated tempering with molecular dynamics.
Tetsuro Nagai
George A. Pantelopulos
Takuya Takahashi
John E. Straub
Published in:
J. Comput. Chem. (2016)
Keyphrases
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molecular dynamics
bayesian inference
probability distribution
state space
markov chain monte carlo
protein folding