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physics.chem-ph2015
Estimation and uncertainty of reversible Markov models
Benjamin Trendelkamp-Schroer, Hao Wu, Fabian Paul +1
Reversibility is a key concept in Markov models and Master-equation models of molecular kinetics. The analysis and interpretation of the transition matrix encoding the kinetic prop…
physics.chem-ph2013★ 178 cited
Projected and Hidden Markov Models for calculating kinetics and metastable states of complex molecules
Frank Noe, Hao Wu, Jan-Hendrik Prinz +1
Markov state models (MSMs) have been successful in computing metastable states, slow relaxation timescales and associated structural changes, and stationary or kinetic experimental…