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physics.data-an2017★ 69 cited
Markov State Models from short non-Equilibrium Simulations - Analysis and Correction of Estimation Bias
Feliks Nüske, Hao Wu, Jan-Hendrik Prinz +3
Many state of the art methods for the thermodynamic and kinetic characterization of large and complex biomolecular systems by simulation rely on ensemble approaches, where data fro…
physics.data-an2012★ 17 cited
Spectral rate theory for projected two-state kinetics
Jan-Hendrik Prinz, John D. Chodera, Frank Noe
Classical rate theories often fail in cases where the observable(s) or order parameter(s) used are poor reaction coordinates or the observed signal is deteriorated by noise, such t…