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20072022
most citedCalculation of the potential of mean force from nonequilibrium measurements via maximum likelihood estimators

34 citations · 90 across the 4 of their papers we have counts for

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cond-mat.stat-mech2009

Arrow of time and non-Markovianity in the non equilibrium folding/unfolding of alanine decapeptide in vacuo

Simone Marsili, Piero Procacci

We present non equilibrium molecular dynamics experiments of the unfolding and refolding of an alanine decapeptide in vacuo subject to a Nose-Hoover thermostat. Forward (unfolding)…