Sfoglia per Autore
CO oxidation mechanism of silver‐substituted Mo/Cu CO‐dehydrogenase. Analogies and differences to the native enzyme
2024 Rovaletti, A; Moro, G; Cosentino, U; Ryde, U; Greco, C
Theoretical Investigation of Inorganic Particulate Matter: The Case of Water Adsorption on a NaCl Particle Model Studied Using Grand Canonical Monte Carlo Simulations
2023 Rizza, F; Rovaletti, A; Carbone, G; Miyake, T; Greco, C; Cosentino, U
Bypassing the statistical limit of singlet generation in sensitized upconversion using fluorinated conjugated systems
2022 Vaghi, L; Rizzo, F; Pedrini, J; Mauri, A; Meinardi, F; Cosentino, U; Greco, C; Monguzzi, A; Papagni, A
Can water act as a nucleophile in CO oxidation catalysed by Mo/Cu CO‐dehydrogenase? Answers from theory
2022 Rovaletti, A; Moro, G; Cosentino, U; Ryde, U; Greco, C
Evaluation of docking procedures reliability in affitins-partners interactions
2022 Ranaudo, A; Cosentino, U; Greco, C; Moro, G; Bonardi, A; Maiocchi, A; Moroni, E
Unraveling the Reaction Mechanism of Mo/Cu CO Dehydrogenase Using QM/MM Calculations
2022 Ritacca, A; Rovaletti, A; Moro, G; Cosentino, U; Ryde, U; Sicilia, E; Greco, C
How general is the effect of the bulkiness of organic ligands on the basicity of metal-organic catalysts? H2-evolving Mo oxides/sulphides as case studies
2022 Rovaletti, A; Ryde, U; Moro, G; Cosentino, U; Greco, C
Calix[4]arene-Based Sensitizers for Host-Guest Supramolecular Dyads for Solar Energy Conversion in Photoelectrochemical Cells
2022 Decavoli, C; Boldrini, C; Faroldi, F; Baldini, L; Sansone, F; Ranaudo, A; Greco, C; Cosentino, U; Moro, G; Manfredi, N; Abbotto, A
Partition of the Reactive Species of the Suzuki-Miyaura Reaction between Aqueous and Micellar Environments
2022 Ranaudo, A; Greco, C; Moro, G; Zucchi, A; Mattiello, S; Beverina, L; Cosentino, U
Computational study on the structural stability of mutated Affitins
2021 Ranaudo, A; Bonardi, A; Cosentino, U; Greco, C; Moro, G; Moroni, E; Maiocchi, A
Julius Robert Mayer and the principle of energy conservation
2021 Aquilini, E; Cosentino, U; Pasqualetti, N; Signori, F
Dynamical behavior and conformational selection mechanism of the intrinsically disordered sic1 kinase-inhibitor domain
2020 Sala, D; Cosentino, U; Ranaudo, A; Greco, C; Moro, G
The Challenging in silico Description of Carbon Monoxide Oxidation as Catalyzed by Molybdenum-Copper CO Dehydrogenase
2019 Rovaletti, A; Bruschi, M; Moro, G; Cosentino, U; Greco, C
Theoretical Insights into the Aerobic Hydrogenase Activity of Molybdenum–Copper CO Dehydrogenase
2019 Rovaletti, A; Bruschi, M; Moro, G; Cosentino, U; Greco, C; Ryde, U
Role of the carbon defects in the catalytic oxygen reduction by graphite nanoparticles: a spectromagnetic, electrochemical and computational integrated approach
2019 Greco, C; Cosentino, U; Pitea, D; Moro, G; Santangelo, S; Patanè, S; D'Arienzo, M; Fiore, M; Morazzoni, F; Ruffo, R
A thiocarbonate sink on the enzymatic energy landscape of aerobic CO oxidation? Answers from DFT and QM/MM models of Mo–Cu CO-dehydrogenases
2019 Rovaletti, A; Bruschi, M; Moro, G; Cosentino, U; Ryde, U; Greco, C
A theoretical study on the reactivity of the Mo/Cu-containing carbon monoxide dehydrogenase with dihydrogen
2017 Breglia, R; Bruschi, M; Cosentino, U; DE GIOIA, L; Greco, C; Miyake, T; Moro, G
Theoretical and experimental investigation of UV–Vis absorption spectrum in a Eu(3+) based complex for luminescent downshifting applications
2017 Cosentino, U; Greco, C; Pitea, D; Binetti, S; Le Donne, A; Moro, G; Baiardi, A
Experimental and Theoretical Investigation on the Catalytic Generation of Environmentally Persistent Free Radicals from Benzene
2017 D'Arienzo, M; Gamba, L; Morazzoni, F; Cosentino, U; Greco, C; Lasagni, M; Pitea, D; Moro, G; Cepek, C; Butera, V; Sicilia, E; Russo, N; Munoz Garcia, A; Pavone, M
IL PIANO LAUREE SCIENTIFICHE: CONSUNTIVI E PROSPETTIVE
2016 Cosentino, U
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