BONDANZA, MATTIA Statistiche

BONDANZA, MATTIA  

DIPARTIMENTO DI CHIMICA E CHIMICA INDUSTRIALE  

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Titolo Data di pubblicazione Autore(i) File
Breaking the Rules: On the Relative Stability of Some Methylencyclopropane and Methylcyclopropene Derivatives 1-gen-2024 Santalucia, D.; Bondanza, M.; Lipparini, F.; Ripszam, M.; Rossi, N.; Mandoli, A.
Structural and quantum chemical basis for OCP-mediated quenching of phycobilisomes 1-gen-2024 Sauer, Paul V.; Cupellini, Lorenzo; Sutter, Markus; Bondanza, Mattia; Agustina Domínguez Martin, María; Kirst, Henning; Bína, David; Fujiet Koh, Adrian; Kotecha, Abhay; Greber, Basil J.; Nogales, Eva; Polívka, Tomáš; Mennucci, Benedetta; Kerfeld, Cheryl A.
The OpenMMPol library for polarizable QM/MM calculations of properties and dynamics 1-gen-2024 Bondanza, Mattia; Nottoli, Tommaso; Nottoli, Michele; Cupellini, Lorenzo; Lipparini, Filippo; Mennucci, Benedetta
Unraveling Water Solvation Effects with Quantum Mechanics/Molecular Mechanics Semiclassical Vibrational Spectroscopy: The Case of Thymidine 1-gen-2024 Moscato, D.; Mandelli, G.; Bondanza, M.; Lipparini, F.; Conte, R.; Mennucci, B.; Ceotto, M.
Catalytic enantioselective alpha-amination of 2-oxindoles and a new route to the bio-active compound AG-041R 1-gen-2023 Bonciolini, Stefano; Bondanza, Mattia; Spadoni, Alberto; Mandoli, Alessandro
QM/AMOEBA description of properties and dynamics of embedded molecules 1-gen-2023 Nottoli, M.; Bondanza, M.; Mazzeo, P.; Cupellini, L.; Curutchet, C.; Loco, D.; Lagardere, L.; Piquemal, J. -P.; Mennucci, B.; Lipparini, F.
Newton-X Platform: New Software Developments for Surface Hopping and Nuclear Ensembles 1-gen-2022 Barbatti, Mario; Bondanza, Mattia; Crespo-Otero, Rachel; Demoulin, Baptiste; Dral, Pavlo O; Granucci, Giovanni; Kossoski, Fábris; Lischka, Hans; Mennucci, Benedetta; Mukherjee, Saikat; Pederzoli, Marek; Persico, Maurizio; Pinheiro, Max; Pittner, Jiří; Plasser, Felix; Sangiogo Gil, Eduarda; Stojanovic, Ljiljana
Trajectory Surface Hopping for a Polarizable Embedding QM/MM Formulation 1-gen-2022 Bondanza, M.; Demoulin, B.; Lipparini, F.; Barbatti, M.; Mennucci, B.
An enhanced sampling QM/AMOEBA approach: The case of the excited state intramolecular proton transfer in solvated 3-hydroxyflavone 1-gen-2021 Nottoli, M.; Bondanza, M.; Lipparini, F.; Mennucci, B.
Molecular Mechanisms of Activation in the Orange Carotenoid Protein Revealed by Molecular Dynamics 1-gen-2020 Bondanza, Mattia; Cupellini, Lorenzo; Faccioli, Pietro; Mennucci, Benedetta
Polarizable embedding QM/MM: the future gold standard for complex (bio)systems? 1-gen-2020 Bondanza, Mattia; Nottoli, Michele; Cupellini, Lorenzo; Lipparini, Filippo; Mennucci, Benedetta
Successes & challenges in the atomistic modeling of light-harvesting and its photoregulation 1-gen-2020 Cupellini, Lorenzo; Bondanza, Mattia; Nottoli, Michele; Mennucci, Benedetta
The Multiple Roles of the Protein in the Photoactivation of Orange Carotenoid Protein 1-gen-2020 Bondanza, Mattia; Cupellini, Lorenzo; Lipparini, Filippo; Mennucci, Benedetta
Asymmetric organocatalytic α-amination of 2-oxindoles with bis(2,2,2-trichloroethyl)azo-dicarboxylate 1-gen-2018 Bondanza, Mattia; Pescitelli, Gennaro; Mandoli, Alessandro