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Titolo Tipologia Data di pubblicazione Autori File
Toward Diiron Dithiolato Biomimetics with Rotated Conformation of the [FeFe]-Hydrogenase Active Site: A DFT Case Study on Electron-Rich, Isocyanide-Based Scaffolds 01 - Articolo su rivista 2022 Arrigoni F.Bertini L.De Gioia L.Zampella G. +
Investigations of the electronic-molecular structure of bio-inorganic systems using modern methods of quantum chemistry 01 - Articolo su rivista 2022 Arrigoni F.Rovaletti A.Bertini L.Breglia R.De Gioia L.Greco C.Vertemara J.Zampella G.Fantucci P.
Geometrical influence on the non-biomimetic heterolytic splitting of H2 by bio-inspired [FeFe]-hydrogenase complexes: a rare example of inverted frustrated Lewis pair based reactivity 01 - Articolo su rivista 2022 Arrigoni F.Zampella G. +
The Photochemistry of Fe2(S2C3H6)(CO)6(µ-CO) and Its Oxidized Form, Two Simple [FeFe]-Hydrogenase CO-Inhibited Models. A DFT and TDDFT Investigation 01 - Articolo su rivista 2021 Arrigoni, FedericaZampella, GiuseppeDe Gioia, LucaGreco, ClaudioBertini, Luca
Challenges in the Synthesis of Active Site Mimics for [NiFe]-Hydrogenases 01 - Articolo su rivista 2021 Arrigoni F.Zampella G. +
Proton Shuttle Mediated by (SCH2)2P= O Moiety in [FeFe]-Hydrogenase Mimics: Electrochemical and DFT Studies 01 - Articolo su rivista 2021 Arrigoni F.Bertini L.De Gioia L.Zampella G. +
Computational and Experimental Investigations of the Fe2(μ-S2)/Fe2(μ-S)2Equilibrium 01 - Articolo su rivista 2021 Arrigoni F.Zampella G. +
CO substitution by PPh3in Fe2S2(CO)6proceeds via a novel Fe2S intermediate 01 - Articolo su rivista 2021 Arrigoni F.Zampella G. +
On the propagation of the OH radical produced by Cu-amyloid beta peptide model complexes. Insight from molecular modelling 01 - Articolo su rivista 2020 Arrigoni, FedericaRizza, FabioTisi, RenataDe Gioia, LucaZampella, GiuseppeBertini, Luca
Insights into the two-electron reductive process of [FeFe]H2ase biomimetics. Cyclic voltammetry and DFT investigation on chelates control of redox properties of [Fe2(CO)4(κ2-chelate)(µ-dithiolate)] 01 - Articolo su rivista 2020 Arrigoni, FedericaDe Gioia, LucaZampella, Giuseppe +
On the importance of cyanide in diiron bridging carbyne complexes, unconventional [FeFe]-hydrogenase mimics without dithiolate: An electrochemical and DFT investigation 01 - Articolo su rivista 2020 Arrigoni F.Bertini L.De Gioia L.Zampella G. +
Functional and structural insights into the MRX/MRN complex, a key player in recognition and repair of DNA double-strand breaks 01 - Articolo su rivista 2020 Tisi R.Vertemara J.Zampella G.Longhese M. P.
Catalytic H2 evolution/oxidation in [FeFe]-hydrogenase biomimetics: account from DFT on the interplay of related issues and proposed solutions 01 - Articolo su rivista 2020 Arrigoni, FedericaBertini, LucaBreglia, RaffaellaGreco, ClaudioDe Gioia, LucaZampella, Giuseppe
DNA binding modes influence Rap1 activity in the regulation of telomere length and MRX functions at DNA ends 01 - Articolo su rivista 2020 Bonetti, DRinaldi, CVertemara, JPizzul, PTisi, RZampella, GLonghese, MP +
Rational Design of Fe2(μ-PR2)2(L)6 Coordination Compounds Featuring Tailored Potential Inversion 01 - Articolo su rivista 2020 Arrigoni F.Rizza F.Vertemara J.Breglia R.Greco C.Bertini L.Zampella G.De Gioia L.
Synthesis, Molecular Modeling and Biological Evaluation of Metabolically Stable Analogues of the Endogenous Fatty Acid Amide Palmitoylethanolamide 01 - Articolo su rivista 2020 D'Aloia, AArrigoni, FTisi, RPalmioli, ACeriani, MArtusa, VAiroldi, CZampella, GCosta, BCipolla, L
The ATP-bound conformation of the Mre11-Rad50 complex is essential for Tel1/ATM activation 01 - Articolo su rivista 2019 Cassani C.Vertemara J.Marsella A.Tisi R.Zampella G.Longhese M. P. +
H2 Activation in [FeFe]-Hydrogenase Cofactor Versus Diiron Dithiolate Models: Factors Underlying the Catalytic Success of Nature and Implications for an Improved Biomimicry 01 - Articolo su rivista 2019 Arrigoni, FedericaBertini, LucaBruschi, MaurizioGreco, ClaudioDe Gioia, LucaZampella, Giuseppe
Synthetic Designs and Structural Investigations of Biomimetic Ni-Fe Thiolates 01 - Articolo su rivista 2019 Arrigoni, FZampella, G +
Towards hydrophobic carminic acid derivatives and their incorporation in polyacrylates 01 - Articolo su rivista 2018 Gabrielli, LucaOriggi, DavideZampella, GiuseppeBertini, LucaBonetti, SimoneVaccaro, GianfrancoMeinardi, FrancescoSimonutti, RobertoCipolla, Laura
Mostrati risultati da 1 a 20 di 109
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