238 citations · 280 across the 3 of their papers we have counts for
4 papers
Coarse-graining Molecular Systems by Spectral Matching
Feliks Nüske, Lorenzo Boninsegna, Cecilia Clementi
Coarse-graining has become an area of tremendous importance within many different research fields. For molecular simulation, coarse-graining bears the promise of finding simplified…
Spectral Properties of Effective Dynamics from Conditional Expectations
Feliks Nüske, Péter Koltai, Lorenzo Boninsegna +1
The reduction of high-dimensional systems to effective models on a smaller set of variables is an essential task in many areas of science. For stochastic dynamics governed by diffu…
Sparse learning of stochastic dynamic equations
Lorenzo Boninsegna, Feliks Nüske, Cecilia Clementi
With the rapid increase of available data for complex systems, there is great interest in the extraction of physically relevant information from massive datasets. Recently, a frame…
Quantum Charge Transport and Conformational Dynamics of Macromolecules
L. Boninsegna, P. Faccioli
We study the dynamics of quantum excitations inside macromolecules which can undergo conformational transitions. In the first part of the paper, we use the path integral formalism…