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Mostrati risultati da 1.382 a 1.401 di 1.951
Titolo Data di pubblicazione Autori Tipo File
Quantum mechanical study of the conformational behavior of proline and 4R-hydroxyproline dipeptide analogues in vacuum and in aqueous solution. 2002 BARONE, Vincenzo + 1.1 Articolo in rivista
Quantum mechanical study of the correlation of attack and recoil angles for the Cl + H2 reaction using the stereodirected and discrete variable representations on two potential energy surfaces 2006 Skouteris, Dimitrios + 1.1 Articolo in rivista
Quantum mechanical study of the correlation of attack and recoil angles for the Li+HF reaction : stereodirected versus discrete variable representations 2007 Skouteris, Dimitrios + 1.1 Articolo in rivista
Quantum Mechanics/Fluctuating Charge Protocol to Compute Solvatochromic Shifts 2021 Ambrosetti M.Skoko S.Giovannini T.Cappelli C. 1.1 Articolo in rivista
Quantum stereodynamics for the two product channels of the F+HD reaction from complete scattering matrix in the stereodirected representation 2009 Skouteris, Dimitrios + 1.1 Articolo in rivista
Quantum-chemical ab initio investigation of the vibrational spectrum of halon 1113 and its anharmonic force field: A joint experimental and computational approach 2012 TASINATO, Nicola + 1.1 Articolo in rivista
QUANTUM-MECHANICAL AND ULTRAVIOLET PHOTOELECTRON SPECTROSCOPIC STUDIES OF AZABIPHENYLS - THE CASE OF 4-PHENYLPYRIMIDINE 1984 BARONE, Vincenzo + 1.1 Articolo in rivista
QUANTUM-MECHANICAL STUDY OF THE CHEMISORPTION OF ATOMIC AND MOLECULAR-OXYGEN ON GRAPHITE CLUSTERS 1986 BARONE, Vincenzo + 1.1 Articolo in rivista
Quartic coupled cluster force fields for the diazene isomers 1993 Koch, Henrik + 1.1 Articolo in rivista
The Quest for a Plausible Formation Route of Formyl Cyanide in the Interstellar Medium: A State-of-the-art Quantum-chemical and Kinetic Approach 2020 Tonolo FrancescaLupi JacopoPuzzarini CristinaBarone Vincenzo 1.1 Articolo in rivista
Radiation-induced formation of DNA intrastrand crosslinks between thymine and adenine bases: a theoretical approach 2006 BARONE, Vincenzo + 1.1 Articolo in rivista
Radical cations of DNA bases: some insights on structure and fragmentation patterns by density functional methods 2000 BARONE, Vincenzo + 1.1 Articolo in rivista
Random-phase calculations of frequency-dependent polarizabilities and hyperpolarizabilities of long polyene chains 1995 Koch, Henrik + 1.1 Articolo in rivista
Rational Design of a Transferrin-Binding Peptide Sequence Tailored to Targeted Nanoparticle Internalization 2017 LUIN, Stefano + 1.1 Articolo in rivista
RATIONALIZATION OF THE ENTHALPY OF PROTONATION OF POLYAMINES 1979 BARONE, Vincenzo + 1.1 Articolo in rivista
Rationalizing the permeation of polar antibiotics into Gram-negative bacteria 2017 D'Agostino, Tommaso + 1.1 Articolo in rivista
Reaction between quinone and thiazolidine. A study on the formation mechanism of new antiproliferative quinolindiones 2004 BARONE, Vincenzo + 1.1 Articolo in rivista
Reaction of dihydrolipoic acid with juglone and related naphthoquinones: unmasking of a spirocyclic 1,3-dithiane intermediate en route to naphtho[1,4]dithiepines 2010 d'Ischia M. + 1.1 Articolo in rivista
Reaction of dopamine with D-glyceraldehyde under biomimetic conditions: Stereoselective formation of tetrahydroisoquinolines and rate-accelerating effects of transition metal ions 1999 D'ISCHIA, MARCO + 1.1 Articolo in rivista
Reaction of malondialdehyde with amine neurotransmitters. Formation and oxidation chemistry of fluorescent 1,4-dihydropyridine adducts 1995 M. D'ISCHIA + 1.1 Articolo in rivista
Mostrati risultati da 1.382 a 1.401 di 1.951
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