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Marco Jacopo Ferrarotti
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Accurate multiple time step in biased molecular simulations
MJ Ferrarotti, S Bottaro, A Pérez-Villa, G Bussi
Journal of chemical theory and computation 11 (1), 139-146, 2015
352015
Watching the release of a photopharmacological drug from tubulin using time-resolved serial crystallography
M Wranik, T Weinert, C Slavov, T Masini, A Furrer, N Gaillard, D Gioia, ...
Nature Communications 14 (1), 903, 2023
182023
Using principal paths to walk through music and visual art style spaces induced by convolutional neural networks
E Gardini, MJ Ferrarotti, A Cavalli, S Decherchi
Cognitive Computation 13, 570-582, 2021
182021
Finding principal paths in data space
MJ Ferrarotti, W Rocchia, S Decherchi
IEEE transactions on neural networks and learning systems 30 (8), 2449-2462, 2018
182018
Cognitive insights into sentic spaces using principal paths
E Ragusa, P Gastaldo, R Zunino, MJ Ferrarotti, W Rocchia, S Decherchi
Cognitive Computation 11, 656-675, 2019
102019
Molecular snapshots of drug release from tubulin over eleven orders of magnitude in time
M Wranik, T Weinert, C Slavov, T Masini, A Furrer, N Gaillard, D Gioia, ...
bioRxiv, 2022.02. 17.480857, 2022
42022
DISTRIBUTED KERNEL KMeans FOR LARGE SCALE CLUSTERING
MJ Ferrarotti, S Decherchi, W Rocchia
32017
Release of a photopharmacological drug from its protein target captured by time-resolved serial crystallography
M Wranik, T Weinert, C Slavov, T Masini, A Furrer, N Gaillard, D Gioia, ...
2022
Release of a photopharmacological drug from its protein target captured by time-resolved serial crystallography (preprint)
M Wranik, T Weinert, C Slavov, T Masini, A Furrer, N Gaillard, D Gioia, ...
2022
Design and HPC implementation of unsupervised Kernel methods in the context of molecular dynamics.
MJ Ferrarotti
University of Genoa, Italy, 2018
2018
High performance computing for simulation of complex phenomena
A Cavalli, S Decherchi, M Ferrarotti, W Rocchia
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Articles 1–11