CAPONE, MATTEO
CAPONE, MATTEO
Dipartimento di Scienze fisiche e chimiche
Unveiling cofactor inhibition mechanisms in horse liver alcohol dehydrogenase: An allosteric driven regulation
2024-01-01 Vetrano, Alice; Capone, Matteo; Farina, Matteo; Gabriele, Francesco; Spreti, Nicoletta; Daidone, Isabella
Mechanisms in the Synthesis of S‐Alcohols with 1,4‐NADH Biomimetic Co‐factor N‐Benzyl‐1,4‐dihydronicotinamide using Horse Liver Alcohol Dehydrogenase: A Hybrid Computational Study
2024-01-01 Farina, Matteo; Capone, Matteo; Bodo, Enrico; Fish, Richard H.; Aschi, Massiliano; Marrone, Alessandro; Daidone, Isabella
Evidence of a Distinctive Enantioselective Binding Mode for the Photoinduced Radical Cyclization of α-Chloroamides in Ene-Reductases
2023-01-01 Capone, Matteo; Dell'Orletta, Gianluca; Nicholls, Bryce T; Scholes, Gregory D; Hyster, Todd K; Aschi, Massimiliano; Daidone, Isabella
Alternative Fast and Slow Primary Charge‐Separation Pathways in Photosystem II
2023-01-01 Capone, Matteo; Sirohiwal, Abhishek; Aschi, Massimiliano; Pantazis, Dimitrios A.; Daidone, Isabella
The electron-proton bottleneck of photosynthetic oxygen evolution
2023-01-01 Greife, Paul; Schönborn, Matthias; Capone, Matteo; Assunção, Ricardo; Narzi, Daniele; Guidoni, Leonardo; Dau, Holger
Molecular dynamics simulations and kinetic measurements provide insights into the structural requirements of substrate size-dependent specificity of oligogalacturonide oxidase 1 (OGOX1)
2023-01-01 Frezzini, Mario; Scortica, Anna; Capone, Matteo; Narzi, Daniele; Benedetti, Manuel; Angelucci, Francesco; Mattei, Benedetta; Guidoni, Leonardo
A combined experimental and computational approach for the rationalization of the catalytic activity of lipase B from Candida antarctica in water-organic solvent mixtures
2023-01-01 Vetrano, A; Daidone, I; Spreti, N; Capone, M
Evidence for a high pK a of an aspartic acid residue in the active site of CALB by a fully atomistic multiscale approach
2023-01-01 Capone, M.; Zanetti-Polzi, L.; Leonzi, I.; Spreti, N.; Daidone, I.
A molecular dynamics-guided mutagenesis identifies two aspartic acid residues involved in the pH-dependent activity of OG-OXIDASE 1
2021-01-01 Scortica, A.; Capone, M.; Narzi, D.; Frezzini, M.; Scafati, V.; Giovannoni, M.; Angelucci, F.; Guidoni, L.; Mattei, B.; Benedetti, M.
Mechanism of Oxygen Evolution and Mn4CaO5 Cluster Restoration in the Natural Water-Oxidizing Catalyst
2021-01-01 Capone, M.; Narzi, D.; Guidoni, L.
Early-stage formation of (hydr)oxo bridges in transition-metal catalysts for photosynthetic processes
2021-01-01 Nakamura, Shin; Capone, Matteo; Mattioli, Giuseppe; Guidoni, Leonardo
Modellizzazione molecolare multiscala del meccanismo fotosintetico di ossidazione dell'acqua
2020-05-06 Capone, Matteo
Pivotal role of the redox-active tyrosine in driving the water splitting catalyzed by photosystem II
2020-01-01 Nakamura, Shin; Capone, Matteo; Narzi, Daniele; Guidoni, Leonardo
Structural and dynamical characterization of the S4 state of the Kok-Joliot's cycle by means of QM/MM Molecular Dynamics Simulations
2020-01-01 Capone, Matteo; Guidoni, Leonardo; Narzi, Daniele
On the comparison between differential vibrational spectroscopy spectra and theoretical data in the carboxyl region of photosystem II
2019-01-01 Capone, Matteo; Narzi, Daniele; Tychengulova, Aliya; Guidoni, Leonardo
Molecular Vibrations of an Oxygen-Evolving Complex and Its Synthetic Mimic
2019-01-01 Tychengulova, A.; Capone, M.; Pitari, F.; Guidoni, L.
Evolution from S3 to S4 States of the Oxygen-Evolving Complex in Photosystem II Monitored by Quantum Mechanics/Molecular Mechanics (QM/MM) Dynamics
2018-01-01 Narzi, Daniele; Capone, Matteo; Bovi, Daniele; Guidoni, Leonardo
Mechanism of Water Delivery to the Active Site of Photosystem II along the S2 to S3 Transition
2016-01-01 Capone, Matteo; Narzi, Daniele; Bovi, Daniele; Guidoni, Leonardo
Vibrational fingerprints of the Mn4CaO5 cluster in Photosystem II by mixed quantum-classical molecular dynamics
2016-01-01 Bovi, Daniele; Capone, Matteo; Narzi, Daniele; Guidoni, Leonardo
Mechanism of Water Delivery to the Active Site of Photosystem II along the S(2) to S(3) Transition
2016-01-01 Capone, Matteo; Narzi, Daniele; Bovi, Daniele; Guidoni, Leonardo