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Journal of Chemical Theory and Computation|March 29, 2018
A Cannibalistic Approach to Grand Canonical Crystal GrowthTarak Karmakar, Pablo M Piaggi, Claudio Perego, et al.
ACS Nano|March 16, 2019
How Defects Control the Out-of-Equilibrium Dissipative Evolution of a Supramolecular TubuleDavide Bochicchio, Supaporn Kwangmettatam, Tibor Kudernac, et al.
Expert Opinion on Drug Discovery|July 6, 2013
Computational design principles for the discovery of bioactive dendrimers: [s]-triazines and other examplesEric E Simanek, Alan E Enciso, Giovanni M Pavan
The Journal of Physical Chemistry. B|January 1, 2020
Identifying and Tracking Defects in Dynamic Supramolecular PolymersPiero Gasparotto, Davide Bochicchio, Michele Ceriotti, et al.
The Journal of Chemical Physics|June 18, 2025
Data-driven assessment of optimal spatiotemporal resolutions for information extraction in noisy time series dataDomiziano Doria, Simone Martino, Matteo Becchi, et al.
Journal of Chemical Theory and Computation|July 2, 2025
Relevant, Hidden, and Frustrated Information in High-Dimensional Analyses of Complex Dynamical Systems with Internal NoiseChiara Lionello, Matteo Becchi, Simone Martino, et al.
Proceedings of the National Academy of Sciences of the United States of America|July 19, 2023
Detecting dynamic domains and local fluctuations in complex molecular systems via timelapse neighbors shufflingMartina Crippa, Annalisa Cardellini, Cristina Caruso, et al.
Nature|September 12, 2020
Author Correction: Self-assembled poly-catenanes from supramolecular toroidal building blocksSougata Datta, Yasuki Kato, Seiya Higashiharaguchi, et al.
Nature|July 17, 2020
Self-assembled poly-catenanes from supramolecular toroidal building blocksSougata Datta, Yasuki Kato, Seiya Higashiharaguchi, et al.
Chemical Science|October 3, 2017
Concentration gradient driven molecular dynamics: a new method for simulations of membrane permeation and separationAydin Ozcan, Claudio Perego, Matteo Salvalaglio, et al.
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