DAIDONE, ISABELLA
DAIDONE, ISABELLA
Dipartimento di Scienze fisiche e chimiche
Intermolecular Photoinduced Electron Transfer in Biosystems: Impact of Conformational Transitions and Multiple Channels on Kinetics
2024-01-01 Zanetti-Polzi, L.; Pantazis, D. A.; Daidone, I.
Tuning the low-temperature phase behavior of aqueous ionic liquids
2024-01-01 Bachler, J.; Daidone, I.; Zanetti-Polzi, L.; Loerting, T.
Unique Electron Donor-Acceptor Complex Conformation Ensures Both the Efficiency and Enantioselectivity of Photoinduced Radical Cyclization in a Non-natural Photoenzyme
2024-01-01 Capone, M.; Dell'Orletta, G.; Page, C. G.; Hyster, T. K.; Scholes, G. D.; Daidone, I.
Applying Computational Spectroscopy Methods to Raman Spectra of Dicationic, Imidazolium-Based, Ionic Liquids
2024-01-01 Farina, M.; Rondino, F.; Lapi, A.; Falconieri, M.; Gagliardi, S.; Daidone, I.; Fraschetti, C.; Bodo, E.; Filippi, A.
Structural and dynamic behaviour of concentrated aqueous solutions of (poly)ethylene glycols: Insight into the impact of hydrophobicity, hydrogen bonding and chain length
2024-01-01 Semmeq, A.; Del Galdo, S.; Chiarini, M.; Daidone, I.; Casieri, C.
Excitation landscape of the CP43 photosynthetic antenna complex from multiscale simulations
2024-01-01 Bhattacharjee, S.; Arra, S.; Daidone, I.; Pantazis, D. A.
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
Early prediction of spinodal-like relaxation events in supercooled liquid water
2024-01-01 Di Fonte, N.; Faccio, C.; Zanetti-Polzi, L.; Daidone, I.
Macromolecular vs molecular crowding in aqueous solutions: A comparative study of PEG400 and ethylene glycol
2024-01-01 Semmeq, A.; Del Galdo, S.; Chiarini, M.; Daidone, I.; Casieri, C.
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
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.
Nanophotonics-based chiroptical sensing of drug solutions
2023-01-01 Adhikary, R.; Sahoo, A.; Aschi, M.; Daidone, I.; Silvestri, M.; Venturi, M.; Ferrante, C.; Mecozzi, A.; Marini, A.
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
Enhanced connectivity and mobility in liquid water: Implications for the high density liquid structure and its onset
2023-01-01 Faccio, C; Di Fonte, N; Daidone, I; Zanetti-Polzi, L
Structural analysis of water networks (vol 11, cnad001, 2023)
2023-01-01 Benzi, M; Daidone, I; Faccio, C; Zanetti-Polzi, L
Thermodynamic Evolution of a Metamorphic Protein: A Theoretical-Computational Study of Human Lymphotactin
2023-01-01 Zanetti-Polzi, L.; Daidone, I.; Iacobucci, C.; Amadei, A.
A statistical mechanical model of supercooled water based on minimal clusters of correlated molecules
2023-01-01 Daidone, I.; Foffi, R.; Amadei, A.; Zanetti-Polzi, L.
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
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
Mechanism and Dynamics of Photodecarboxylation Catalyzed by Lactate Monooxygenase
2023-01-01 Li, Xiankun; Page, Claire G; Zanetti-Polzi, Laura; Kalra, Aarat P; Oblinsky, Daniel G; Daidone, Isabella; Hyster, Todd K; Scholes, Gregory D