AMADEI, ANDREA

AMADEI, ANDREA  

Dipartimento di Scienze fisiche e chimiche  

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Risultati 1 - 15 di 15 (tempo di esecuzione: 0.021 secondi).
Titolo Data di pubblicazione Autore(i) File
Thermodynamic Evolution of a Metamorphic Protein: A Theoretical-Computational Study of Human Lymphotactin 1-gen-2023 Zanetti-Polzi, L.; Daidone, I.; Iacobucci, C.; Amadei, A.
Theoretical–Computational Modeling of CD Spectra of Aqueous Monosaccharides by Means of Molecular Dynamics Simulations and Perturbed Matrix Method 1-gen-2023 Aschi, M.; Palombi, L.; Amadei, A.
Theoretical-Computational Modeling of Gas-State Thermodynamics in Flexible Molecular Systems: Ionic Liquids in the Gas Phase as a Case Study 1-gen-2022 Amadei, A.; Ciccioli, A.; Filippi, A.; Fraschetti, C.; Aschi, M.
A general statistical mechanical model for fluid system thermodynamics: Application to sub- and super-critical water 1-gen-2022 Zanetti-Polzi, L.; Daidone, I.; Amadei, A.
Segregation on the nanoscale coupled to liquid water polyamorphism in supercooled aqueous ionic-liquid solution 1-gen-2021 Zanetti-Polzi, L.; Amadei, A.; Daidone, I.
Length-scale dependence of protein hydration-shell density 1-gen-2020 Biswas, A. D.; Barone, V.; Amadei, A.; Daidone, I.
Fully Atomistic Multiscale Approach for pKa Prediction 1-gen-2020 Zanetti-Polzi, L.; Daidone, I.; Amadei, A.
Modeling amino-acid side chain infrared spectra: The case of carboxylic residues 1-gen-2020 Vieira Pinto, S. M.; Tasinato, N.; Barone, V.; Amadei, A.; Zanetti-Polzi, L.; Daidone, I.
Interpretation of Experimental Soret Bands of Porphyrins in Flexible Covalent Cages and in Their Related Ag(I) Fixed Complexes 1-gen-2019 Zanetti-Polzi, L.; Amadei, A.; Djemili, R.; Durot, S.; Schoepff, L.; Heitz, V.; Ventura, B.; Daidone, I.
Modelling vibrational relaxation in complex molecular systems 1-gen-2019 Amadei, A.; Aschi, M.
A quantitative connection of experimental and simulated folding landscapes by vibrational spectroscopy 1-gen-2018 Davis, Caitlin M.; Zanetti-Polzi, Laura; Gruebele, Martin; Amadei, Andrea; Dyer, R. Brian; Daidone, Isabella
Extending the perturbed matrix method beyond the dipolar approximation: comparison of different levels of theory 1-gen-2018 Zanetti-Polzi, Laura; Del Galdo, Sara; Daidone, Isabella; D'Abramo, Marco; Barone, Vincenzo; Aschi, Massimiliano; Amadei, Andrea
Tyrosine absorption spectroscopy: Backbone protonation effects on the side chain electronic properties 1-gen-2018 Del Galdo, Sara; Mancini, Giordano; Daidone, Isabella; Zanetti Polzi, Laura; Amadei, Andrea; Barone, Vincenzo
Theoretical-computational modeling of charge transfer and intersystem crossing reactions in complex chemical systems 1-gen-2018 Amadei, A.; Aschi, M.
Photoexcitation and relaxation kinetics of molecular systems in solution: Towards a complete: In silico model 1-gen-2016 Aschi, M.; Barone, V.; Carlotti, B.; Daidone, I.; Elisei, F.; Amadei, A.