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Direct Hydrogenation of Carbon Dioxide by an Artifi cial Reductase Obtained by Substituting Rhodium for Zinc in the Carbonic Anhydrase Catalytic Center. A Mechanistic Study 1-gen-2015 Piazzetta, P.; Marino, Tiziana; N., Russo; Dennis R., Salahub
Enzymatic Flexibility and Reaction Rate: A QM/MM Study of HIV-1 Protease 1-gen-2015 António J. M., Ribeiro; Diogo Santos, Martins; Russo, Nino; Maria J., Ramos; Pedro A., Fernandes
How the Destabilization of a Reaction Intermediate Affects Enzymatic Efficiency: The Case of Human Transketolase 1-gen-2020 Prejanò, Mario; Medina, Fabiola E.; Ramos, Maria J.; Russo, Nino; Fernandes, Pedro A.; Marino, Tiziana
Insights into the Catalytic Mechanism of Domains CD1 and CD2 in Histone Deacetylase 6 from Quantum Calculations 1-gen-2021 Prejano', Mario; Vidossich, Pietro; Russo, Nino; De Vivo, Marco; Marino, Tiziana
Natural Alginate as a Graphene Precursor and Template in the Synthesis of Nanoparticulate Ceria/Graphene Water Oxidation Photocatalysts 1-gen-2014 Lavorato, C; Primo, A; Molinari, Raffaele; Garcia, H.
Pd Supported on Carbon Nitride Boosts the Direct Hydrogen Peroxide Synthesis 1-gen-2016 Arrigo, R.; Schuster, M. E.; Abate, S.; Giorgianni, G.; Centi, G.; Perathoner, S.; Wrabetz, S.; Pfeifer, V.; Antonietti, M.; Schlogl, R.
Stabilized Ru[(H2O)6]3+ in Confined Spaces (MOFs and Zeolites) Catalyzes the Imination of Primary Alcohols under Atmospheric Conditions with Wide Scope 1-gen-2018 Mon, Marta; Adam, Rosa; Ferrando-Soria, Jesus; CORMA CANOS, Avelino; Armentano, Donatella; Pardo, Emilio; Leyva-Perez, Antonio
The Role of Chelating Phosphine Rhodium Complexes in Dehydrocoupling Reactions of Amine-Boranes: A Theoretical Investigation Attempting To Rationalize the Observed Behaviors 1-gen-2014 Valeria, Butera; Russo, Nino; Sicilia, Emilia
Unraveling the Reaction Mechanism of Mo/Cu CO Dehydrogenase Using QM/MM Calculations 1-gen-2022 G Ritacca, Alessandra; Rovaletti, Anna; Moro, Giorgio; Cosentino, Ugo; Ryde, Ulf; Sicilia, Emilia; Greco, Claudio
Water Molecules Allow the Intramolecular Activation of the Thiamine Di-Phosphate Cofactor in Human Transketolase: Mechanistic Insights into a Famous Proposal 1-gen-2021 Medina, Fabiola E.; Prejano', Mario
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