CIMINO, Paola

CIMINO, Paola  

Dipartimento di Farmacia/DIFARMA  

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Risultati 1 - 20 di 59 (tempo di esecuzione: 0.026 secondi).
Titolo Data di pubblicazione Autore(i) File
Ab initio computation of spectroscopic parameters as a tool for the structural elucidation of organic systems. 1-gen-2007 Barone, Vincenzo; Cimino, Paola; Crescenzi, Orlando; Pavone, Michele
Ab Initio Modeling of CW-ESR Spectra of the Double Spin Labeled Peptide Fmoc-(Aib-Aib-TOAC)2-Aib-OMe in Acetonitrile 1-gen-2007 Zerbetto, M; Carlotto, S; Polimeno, A; Corvaja, C; Franco, L; Toniolo, C; Formaggio, F; Barone, V; Cimino, Paola
Accurate and feasible computations of structural and magnetic properties of large free radicals: The PBE0/N07D model 1-gen-2008 Vincenzo, Barone; Cimino, Paola
Accurate Infrared (IR) Spectra for Molecules Containing the C≡N Moiety by Anharmonic Computations with the Double Hybrid B2PLYP Density Functional 1-gen-2015 Vazart, Fanny; Latouche, Camille; Cimino, Paola; Barone, Vincenzo
An integrated computational protocol for the accurate prediction of EPR and PNMR parameters of aminoxyl radicals in solution 1-gen-2010 Barone, Vincenzo; Cimino, Paola; Pedone, Alfonso
Aplysiols A and B, squalene-derived polyethers from the mantle of the sea hare Aplysia dactylomela 1-gen-2007 E., Manzo; M., Gavagnin; Bifulco, Giuseppe; Cimino, Paola; S., DI MICCO; M. L., Ciavatta; Y. W., Guo; G., Cimino
Calculation of Magnetic Tensors and EPR Spectra for Free Radicals in Different Environments 1-gen-2010 Cimino, Paola; Neese, Frank; Barone, Vincenzo
CC/DFT Route toward Accurate Structures and Spectroscopic Features for Observed and Elusive Conformers of Flexible Molecules: Pyruvic Acid as a Case Study 1-gen-2015 Barone, Vincenzo; Biczysko, Malgorzata; Bloino, Julien; Cimino, Paola; Penocchio, Emanuele; Puzzarini, Cristina
Chemical composition of exopolysaccharide fractions from phytopathogenic strains of Pseudomonas syringae subsp. savastanoi. 1-gen-1998 Cimino, Paola; P, Corsaro; M. M, Evidente; A, Lanzetta; R, Molinaro; A, Parrilli; M, Sfalanga; A, Guastini; M, Surico
Comparison of different theory models and basis sets in the calculation of 13C NMR chemical shifts of natural products 1-gen-2004 Cimino, Paola; GOMEZ PALOMA, L.; Duca, D.; Riccio, Raffaele; Bifulco, Giuseppe
Cost-effective solar concentrators based on red fluorescent Zn(ii)–salicylaldiminato complex 1-gen-2016 Minei, Pierpaolo; Fanizza, Elisabetta; Rodríguez, Antonio M.; Muñoz García, Ana B.; Cimino, Paola; Pavone, Michele; Pucci, Andrea
Cross-linked adducts between guanine and thymine mediated by hydroxyl radical and one-electron oxidation: a theoretical study 1-gen-2008 Vanessa, Labet; Christophe, Morell; Andrè, Grand; Jean, Cadet; Cimino, Paola; Vincenzo, Barone
Development and Validation of an Integrated Computational Approach for the Modeling of cw-ESR Spectra of Free Radicals in Solution: p-(Methylthio)phenyl Nitronylnitroxide in Toluene as a Case Study. 1-gen-2006 Barone, V; Brustolon, M; Cimino, Paola; Polimeno, A; Zerbetto, M; Zoleo, A.
Development and validation of the B3LYP/N07D computational model for structural parameter and magnetic tensors of large free radicals 1-gen-2008 Vincenzo, Barone; Cimino, Paola; Emiliano, Stendardo
Double C-H Activation of Ethane by Metal-Free SO(2)(center dot+) Radical Cations 1-gen-2010 de Petris, Giulia; Cartoni, Antonella; Troiani, Anna; Barone, Vincenzo; Cimino, Paola; Angelini, Giancarlo; Ursini, Ornella
Effects of molecular dynamics and solvation on the electronic structure of molecular probes 1-gen-2012 Caruso, Pasquale; Causa, Mauro; Cimino, Paola; Crescenzi, Orlando; D'Amore, Maddalena; Improta, Roberto; Pavone, Michele; Rega, Nadia
EPR spectra of organic free radicals in solution from an integrated computational approach 1-gen-2007 Barone, Vincenzo; Cimino, Paola; Pavone, Michele
Evidence of Variable H-Bond Network for Nitroxide Radicals in Protic Solvents 1-gen-2006 Pavone, M; Sillanpaeae, A; Cimino, Paola; Crescenzi, O; Barone, V.
Excited State Time-Resolved Vibrational Dynamics: the Challenge of Charge Transfer Complexes 1-gen-2019 Coppola, Federico; Cimino, Paola; Raucci, Umberto; Chiariello Maria, Gabriella; Rega, Nadia
Exploring the Franck–Condon region of a photoexcited charge transfer complex in solution to in-terpret femtosecond stimulated Raman spectroscopy: excited state electronic structure methods to unveil non-radiative pathways 1-gen-2021 Coppola, Federico; Cimino, Paola; Raucci, Umberto; Gabriella Chiariello, Maria; Petron, Alessio; Nadia Rega, E