PREJANO', MARIO
PREJANO', MARIO
Dipartimento di Chimica e Tecnologie Chimiche
Antioxidant and copper-chelating power of new molecules suggested as multiple target agents against Alzheimer's disease. A theoretical comparative study
2022-01-01 Spiegel, Maciej; Marino, Tiziana; Prejanò, Mario; Russo, Nino
Antioxidant properties of the Vam3 derivative of resveratrol
2018-01-01 Ahmadi, Seyedmohammad; Marino, Tiziana; Prejanò, Mario; Russo, Nino; Toscano, Marirosa
Can Fused Thiophene-Pyrrole Containing Rings act as Possible New Electrochromic Dyes ? A Computational Prediction
2016-01-01 DE SIMONE, Bruna Clara; Marino, Tiziana; Prejanò, M; Russo, Nino
Capsaicin, a Powerful •OH-Inactivating Ligand
2020-01-01 Pérez-González, Adriana; Prejanò, Mario; Russo, Nino; Marino, Tiziana; Galano, Annia
Chapter 2: Computational Enzymology: A Challenge for Multiscale Approaches
2022-01-01 Marino, T.; Alberto, M. E.; Prejano, M.; Russo, N.; Toscano, M.
Computational Study of Mechanism and Enantioselectivity of Imine Reductase from Amycolatopsis orientalis
2022-01-01 Prejano, Mario; Sheng, Xiang; Himo, Fahmi
Computational Study Reveals the Role of Water Molecules in the Inhibition Mechanism of LAT1 by 1,2,3-Dithiazoles
2021-01-01 Prejanò, Mario; Romeo, Isabella; La Serra, Maria Antonietta; Russo, Nino; Marino, Tiziana
Degradation of Penicillinic Antibiotics and β-Lactamase Enzymatic Catalysis in a Biomimetic Zn-Based Metal-Organic Framework
2023-01-01 Escamilla, Paula; Bartella, Lucia; Sanz-Navarro, Sergio; Percoco, Rita Maria; Di Donna, Leonardo; Prejanò, Mario; Marino, Tiziana; Ferrando-Soria, Jesús; Armentano, Donatella; Leyva-Pérez, Antonio; Pardo, Emilio
Dehydrogenation of formic acid to CO2 and H2 by manganese(I)–complex: Theoretical insights for green and sustainable route
2021-01-01 Marino, T.; Prejano, M.
Effect of Copper on the Mitochondrial Carnitine/Acylcarnitine Carrier Via Interaction with Cys136 and Cys155. Possible Implications in Pathophysiology
2020-01-01 Giangregorio, Nicola; Tonazzi, Annamaria; Console, Lara; Prejanò, Mario; Marino, Tiziana; Russo, Nino; Indiveri, Cesare
Exploring the structure-performance relationship of sulfonated polysulfone proton exchange membrane by a combined computational and experimental approach
2021-01-01 Simari, C.; Prejano, M.; Lufrano, E.; Sicilia, E.; Nicotera, I.
Heavy atom effect through chalcogen substitution in Red Nile dye: a theoretical investigation
2023-01-01 Alberto, Marta E.; Prejanò, Mario; Marino, Tiziana; De Simone, Bruna C.; Toscano, Marirosa; Russo, Nino
How can work methanol dehydrogenase from Methylacidiphilum fumariolicum with the alien Ce(III) ion in the active center? A theoretical study
2017-01-01 Marino, T.; Prejanò, M.; Russo, N.
How metal coordination in the Ca-, Ce-, and Eu-containing methanol dehydrogenase enzymes can influence the catalysis: A theoretical point of view
2019-01-01 Marino, T.; Prejano, M.; Russo, N.
How the Destabilization of a Reaction Intermediate Affects Enzymatic Efficiency: The Case of Human Transketolase
2020-01-01 Prejanò, Mario; Medina, Fabiola E.; Ramos, Maria J.; Russo, Nino; Fernandes, Pedro A.; Marino, Tiziana
How the lanthanide ions affect the addtion-elimination step of methanol dehydrogenases
2020-01-01 Prejano', Mario; Russo, Nino; Marino, Tiziana
Hydrolase–like catalysis and structural resolution of natural products by a metal–organic framework
2020-01-01 Mon, M.; Bruno, R.; Sanz-Navarro, S.; Negro, C.; Ferrando-Soria, J.; Bartella, L.; Di Donna, L.; Prejano, M.; Marino, T.; Leyva-Perez, A.; Armentano, D.; Pardo, E.
Incorporation of N7-Platinated Guanines into Thermus Aquaticus (Taq) DNA Polymerase: Atomistic Insights from Molecular Dynamics Simulations
2023-01-01 De Castro, Federica; Ciardullo, Giada; Fanizzi, Francesco Paolo; Prejanò, Mario; Benedetti, Michele; Marino, Tiziana
Inhibition of the carnitine acylcarnitine carrier by carbon monoxide reveals a novel mechanism of action with non-metal-containing proteins
2022-01-01 Tonazzi, A.; Giangregorio, N.; Console, L.; Calvano, C. D.; Prejano, M.; Scalise, M.; Incampo, G.; Marino, T.; Russo, N.; Cataldi, T. R. I.; Indiveri, C.
Insights into the Catalytic Mechanism of Domains CD1 and CD2 in Histone Deacetylase 6 from Quantum Calculations
2021-01-01 Prejano', Mario; Vidossich, Pietro; Russo, Nino; De Vivo, Marco; Marino, Tiziana