Nano-biocomposite films with modified cellulose nanocrystals and synthesized silver nanoparticles E Fortunati, S Rinaldi, M Peltzer, N Bloise, L Visai, I Armentano, ... Carbohydrate polymers 101, 1122-1133, 2014 | 205 | 2014 |
Allosteric modulators of HSP90 and HSP70: dynamics meets function through structure-based drug design M Ferraro, I D’Annessa, E Moroni, G Morra, A Paladino, S Rinaldi, ... Journal of medicinal chemistry 62 (1), 60-87, 2018 | 92 | 2018 |
Comparison of the isomerization mechanisms of human melanopsin and invertebrate and vertebrate rhodopsins S Rinaldi, F Melaccio, S Gozem, F Fanelli, M Olivucci Proceedings of the National Academy of Sciences 111 (5), 1714-1719, 2014 | 72 | 2014 |
Toward automatic rhodopsin modeling as a tool for high-throughput computational photobiology F Melaccio, M del Carmen Marín, A Valentini, F Montisci, S Rinaldi, ... Journal of Chemical Theory and Computation 12 (12), 6020-6034, 2016 | 71 | 2016 |
PLGA/Ag nanocomposites: in vitro degradation study and silver ion release E Fortunati, L Latterini, S Rinaldi, JM Kenny, I Armentano Journal of Materials Science: Materials in Medicine 22, 2735-2744, 2011 | 71 | 2011 |
Molecular bases for the selection of the chromophore of animal rhodopsins HL Luk, F Melaccio, S Rinaldi, S Gozem, M Olivucci Proceedings of the National Academy of Sciences 112 (50), 15297-15302, 2015 | 53 | 2015 |
Learning from photobiology how to design molecular devices using a computer S Gozem, F Melaccio, HL Luk, S Rinaldi, M Olivucci Chemical Society Reviews 43 (12), 4019-4036, 2014 | 46 | 2014 |
Disulfide bond mimetics: strategies and challenges A Gori, P Gagni, S Rinaldi Chemistry–A European Journal 23 (60), 14987-14995, 2017 | 42 | 2017 |
Integrated PLGA–Ag nanocomposite systems to control the degradation rate and antibacterial properties S Rinaldi, E Fortunati, M Taddei, JM Kenny, I Armentano, L Latterini Journal of Applied Polymer Science 130 (2), 1185-1193, 2013 | 36 | 2013 |
Origin of Fluorescence in 11-cis Locked Bovine Rhodopsin EN Laricheva, S Gozem, S Rinaldi, F Melaccio, A Valentini, M Olivucci Journal of Chemical Theory and Computation 8 (8), 2559-2563, 2012 | 35 | 2012 |
Protein design: from computer models to artificial intelligence A Paladino, F Marchetti, S Rinaldi, G Colombo Wiley Interdisciplinary Reviews: Computational Molecular Science 7 (5), e1318, 2017 | 30 | 2017 |
Machine learning of allosteric effects: the analysis of ligand-induced dynamics to predict functional effects in TRAP1 M Ferraro, E Moroni, E Ippoliti, S Rinaldi, C Sanchez-Martin, A Rasola, ... The Journal of Physical Chemistry B 125 (1), 101-114, 2020 | 25 | 2020 |
A local allosteric network in heat shock protein 70 (Hsp70) links inhibitor binding to enzyme activity and distal protein–protein interactions S Rinaldi, VA Assimon, ZT Young, G Morra, H Shao, IR Taylor, ... ACS chemical biology 13 (11), 3142-3152, 2018 | 23 | 2018 |
Understanding complex mechanisms of enzyme reactivity: the case of Limonene-1, 2-epoxide hydrolases S Rinaldi, MW Van der Kamp, KE Ranaghan, AJ Mulholland, G Colombo Acs Catalysis 8 (7), 5698-5707, 2018 | 23 | 2018 |
Tryptophan scanning mutagenesis as a way to mimic the compound-bound state and probe the selectivity of allosteric inhibitors in cells IR Taylor, VA Assimon, SY Kuo, S Rinaldi, X Li, ZT Young, G Morra, ... Chemical science 11 (7), 1892-1904, 2020 | 16 | 2020 |
Biodegradable PLGA matrix nanocomposite with silver nanoparticles: material properties and bacteria activity I Armentano, E Fortunati, L Latterini, S Rinaldi, E Saino, L Visai, F Elisei, ... Journal of Nanostructured Polymers and Nanocomposites 6 (4), 110-117, 2010 | 12 | 2010 |
Setup and validation of a reliable docking protocol for the development of neuroprotective agents by targeting the sigma-1 receptor (S1R) G Rossino, M Rui, L Pozzetti, D Schepmann, B Wünsch, D Zampieri, ... International Journal of Molecular Sciences 21 (20), 7708, 2020 | 7 | 2020 |
Mechanistic model for the Hsp90-driven opening of human Argonaute S Rinaldi, G Colombo, A Paladino Journal of Chemical Information and Modeling 60 (3), 1469-1480, 2020 | 6 | 2020 |
The dynamics of t1 adenosine binding on human Argonaute 2: Understanding recognition with conformational selection S Rinaldi, G Colombo, A Paladino Protein Science 31 (8), e4377, 2022 | 5 | 2022 |
Unraveling energy and dynamics determinants to interpret protein functional plasticity: the limonene-1, 2-epoxide-hydrolase case study S Rinaldi, A Gori, C Annovazzi, EE Ferrandi, D Monti, G Colombo Journal of Chemical Information and Modeling 57 (4), 717-725, 2017 | 5 | 2017 |