226 citations · 695 across the 31 of their papers we have counts for
4 papers · 1 filter
Fast, accurate, and system-specific variable-resolution modelling of proteins
Raffaele Fiorentini, Thomas Tarenzi, Raffaello Potestio
In recent years, a few multiple-resolution modelling strategies have been proposed, in which functionally relevant parts of a biomolecule are described with atomistic resolution, w…
Information-theoretical measures identify accurate low-resolution representations of protein configurational space
Margherita Mele, Roberto Covino, Raffaello Potestio
A steadily growing computational power is employed to perform molecular dynamics simulations of biological macromolecules, which represents at the same time an immense opportunity…
Making sense of complex systems through resolution, relevance, and mapping entropy
Roi Holtzman, Marco Giulini, Raffaello Potestio
Complex systems are characterised by a tight, nontrivial interplay of their constituents, which gives rise to a multi-scale spectrum of emergent properties. In this scenario, it is…
Coarse-grained Mori-Zwanzig dynamics in a time-non-local stationary-action framework
Piero Luchi, Roberto Menichetti, Gianluca Lattanzi +1
Coarse-grained (CG) models are simplified representations of soft matter systems that are commonly employed to overcome size and time limitations in computational studies. Many app…