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An unconventional ligand-binding mechanism of substrate-binding proteins: MD simulation and Markov state model analysis of BtuF.
Dongdong Wang
Jingwei Weng
Wenning Wang
Published in:
J. Comput. Chem. (2019)
Keyphrases
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mathematical model
probabilistic model
computational model
simulation model
markov model
semi markov
high level
statistical model
similarity measure
markov chain
simulation environment