Sfoglia per ???browse.type.metadata.discipline??? Chimica e Geologia
Formation of Phosphorus Monoxide (PO) in the Interstellar Medium: Insights from Quantum-chemical and Kinetic Calculations
2021 García de la Concepción, Juan; Puzzarini, Cristina; Barone, Vincenzo; Jiménez-Serra, Izaskun; Roncero, Octavio
FRACTIONAL POPULATIONS OF INDIVIDUAL CONFORMERS IN MULTIDIHEDRAL SYSTEMS - A J COUPLING-CONSTANT APPROACH
1985 Barone, Vincenzo; Lelj, F; Abbate, G.
Fragment Localized Molecular Orbitals
2022 Giovannini, Tommaso; Koch, Henrik
Free Energy Landscapes of Ion Coordination in Aqueous Solution
2011 Brancato, Giuseppe; Barone, Vincenzo
Free Radical Coupling ofo-Semiquinones Uncovered
2013 Alessandro, Pezzella; Orlando, Crescenzi; Lucia, Panzella; Alessandra, Napolitano; Edward J., Land; Barone, Vincenzo; Marco, D’Ischia; D'Ischia, Marco
Free radical oxidation of (E)-retinoic acid by the Fenton reagent: competing epoxidation and oxidative breakdown pathways and novel products of 5,6-epoxyretinoic acid transformation
2004 Panzella, Lucia; Manini, Paola; Napolitano, Alessandra; D'Ischia, Marco
Free radical oxidation of 15-(S)-hydroxyeicosatetraenoic acid with the Fenton reagent: characterization of an epoxy-alcohol and cytotoxic 4-hydroxy-2E-nonenal from the heptatrienyl radical pathway
2006 Manini, Paola; Briganti, S; Fabbri, C; Picardo, M; Napolitano, Alessandra; D'Ischia, Marco
Free radical oxidation of coriolic acid (13-(S)-hydroxy-9Z,11E-octadecadienoic acid
2005 Manini, Paola; E., Camera; M., Picardo; Napolitano, Alessandra; D'Ischia, Marco
Frequency-dependent first hyperpolarizabilities using coupled cluster quadratic response theory
1997 Hättig, Christof; Christiansen, Ove; Koch, Henrik; Jørgensen, Poul
FREQUENCY-DEPENDENT HYPERPOLARIZABILITIES OF POLYYNES
1993 Jaszunski, M; Jorgensen, P; Koch, H; Agren, H; Helgaker, T
From ascorbic acid to furan derivatives: The gas phase acid catalyzed degradation of vitamin C
2018 Cimino, Paola; Troiani, Anna; Pepi, Federico; Garzoli, Stefania; Salvitti, Chiara; Di Rienzo, Brunella; Barone, Vincenzo; Ricci, Andreina
From classical density functionals to adiabatic connection methods. The state of the art
1999 Adamo, C.; DI MATTEO, A.; Barone, Vincenzo
From clinical description, to in vitro and animal studies, and backward to patients: Oxidative stress and mitochondrial dysfunction in Fanconi anemia
2013 Pagano, G; Talamanca, Aa; Castello, G; D'Ischia, Marco; Pallardo, Fv; Petrovic, S; Porto, B; Tiano, L; Zatterale, A.
From commercial tyrosine polymers to a tailored polydopamine platform: Concepts, issues and challenges en route to melanin-based bioelectronics
2015 Ambrico, Marianna; Ambrico, Paolo F.; Ligonzo, Teresa; Cardone, Antonio; Cicco, Stefania R.; D'Ischia, Marco; Farinola, Gianluca M.
FROM CONCEPTS TO ALGORITHMS FOR THE CHARACTERIZATION OF REACTION-MECHANISMS - H2CS AS A CASE-STUDY
1994 Minichino, C; Barone, Vincenzo
FROM CONCEPTS TO ALGORITHMS FOR THE TREATMENT OF LARGE-AMPLITUDE INTERNAL MOTIONS AND UNIMOLECULAR REACTIONS
1995 Barone, Vincenzo; Minichino, C.
From Melanins to New Electroluminescent Materials for Bio-Inspired OLED Applications
2015 Manini, Paola; Criscuolo, Valeria; Pezzella, Alessandro; Crescenzi, Orlando; D’Ischia, Marco
From Melanins to OLED Devices: Taking Inspiration from the Black Human Pigments for the Design of Innovative Electroluminescent Materials
2017 Manini, Paola; Prontera, Carmela Tania; Criscuolo, Valeria; Pezzella, Alessandro; Crescenzi, Orlando; Pavone, Michele; D’Ischia, Marco
From Molecular Electrostatic Potentials to Solvation Models and Ending with Biomolecular Photophysical Processes
2010 J., Tomasi; Cappelli, Chiara; B., Mennucci; R., Cammi
From reactants to products via simple hydrogen-bonding networks: Information transmission in chemical reactions
2002 Brancato, Giuseppe; Coutrot, F; Leigh, Da; Murphy, A; Wong, Jky; Zerbetto, F.
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