252 citations · 1k across the 43 of their papers we have counts for
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physics.chem-ph2016★ 19 cited
Concurrent parametrization against static and kinetic information leads to more robust coarse-grained force fields
Joseph F. Rudzinski, Tristan Bereau
The parametrization of coarse-grained (CG) simulation models for molecular systems often aims at reproducing static properties alone. The reduced molecular friction of the CG repre…
physics.chem-ph2016★ 36 cited
Consistent interpretation of molecular simulation kinetics using Markov state models biased with external information
Joseph F. Rudzinski, Kurt Kremer, Tristan Bereau
Molecular simulations can provide microscopic insight into the physical and chemical driving forces of complex molecular processes. Despite continued advancement of simulation meth…