A review of Girsanov reweighting and of square root approximation for building molecular Markov state models

Dynamical reweighting methods permit to estimate kinetic observables of a stochastic process governed by a target potential Ṽ(x) from trajectories that have been generated at a different potential V(x). In this article, we present Girsanov reweighting and square root approximation: the first method...

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Veröffentlicht in:	Journal of mathematical physics 2022-12, Vol.63 (12)
Hauptverfasser:	Donati, Luca, Weber, Marcus, Keller, Bettina G.
Format:	Artikel
Sprache:	eng
Schlagworte:	Approximation Mathematical analysis Molecular dynamics Physics Stochastic processes Transition probabilities
Online-Zugang:	Volltext
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