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physics.data-an2012
Optimal estimation of free energies and stationary densities from multiple biased simulations
Hao Wu, Frank Noé
When studying high-dimensional dynamical systems such as macromolecules, quantum systems and polymers, a prime concern is the identification of the most probable states and their s…
math-ph2012
A variational approach to modeling slow processes in stochastic dynamical systems
Frank Noé, Feliks Nüske
The slow processes of metastable stochastic dynamical systems are difficult to access by direct numerical simulation due the sampling problem. Here, we suggest an approach for mode…
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…