10 citations · 10 across the 4 of their papers we have counts for
4 papers
Unveiling the entropic role of hydration water in SOD1 partitioning within FUS condensate
Luis Enrique Coronas, Stepan Timr, Fabio Sterpone +1
Biological processes like the sequestration of Superoxide Dismutase 1 (SOD1) into biomolecular condensates such as FUS and stress granules are essential to understanding disease me…
Explicit models of motions to understand protein side-chain dynamics
Nicolas Bolik-Coulon, Olivier Languin-Cattoën, Diego Carnevale +5
Nuclear magnetic relaxation is widely used to probe protein dynamics. For decades, most analyses of relaxation in proteins have relied successfully on the model-free approach, forg…
Three-level multilevel simulation of the neuroreceptor function of NMDA
Francesco Di Palma, Sauro Succi, Fabio Sterpone +3
We present a new multiscale method to study the N-Methyl-D-Aspartate (NMDA) neuroreceptor starting from the reconstruction of its crystallographic structure. Thanks to the combinat…
Dissecting the hydrogen bond: a Quantum Monte Carlo approach
Fabio Sterpone, Leonardo Spanu, Luca Ferraro +2
We present a variational MonteCarlo (VMC) and lattice regularized diffusion MonteCarlo (LRDMC) study of the binding energy and dispersion curve of the water dimer. As a variation a…