Sfoglia per Autore
“Theoretical study of three medicinal bioinorganic systems”
2005-01-01 Marrone, Alessandro
Photophysical properties of [Ru(phen)2(dppz)]2+ intercalated into DNA: an integrated Car-Parrinello and TDDFT study
2005-01-01 Fantacci, S; DE ANGELIS, F; Sgamellotti, A; Marrone, Alessandro; Re, Nazzareno
Reactivity of transition metal allenylidene complexes with nucleophiles: a density functional study
2006-01-01 Re, Nazzareno; Marrone, Alessandro; Coletti, Cecilia
``DFT study of carboplatin hydrolysis in neutral and acidic media"
2006-01-01 N., Re; Marrone, Alessandro; Coletti, Cecilia; N., Besker
A density functional study of ruthenium(II) and ruthenium(III) interaction with nucleobases
2006-01-01 Re, Nazzareno; N., Besker; Coletti, Cecilia; Marrone, Alessandro
A theoretical investigation of the hydrolysis and reduction of NAMI(A)-type ruthenium complexes
2006-01-01 Re, Nazzareno; N., Besker; Coletti, Cecilia; Marrone, Alessandro
Poly(ADP-ribose)-polymerase-catalyzed hydrolysis of NAD+: QM/MM simulation of the enzyme reaction
2006-01-01 Bellocchi, D; Costantino, G; Pellicciari, R; Re, Nazzareno; Marrone, Alessandro; Coletti, Cecilia
Non-radical mechanisms for the uncatalyzed thermal functionalization of silicon surfaces by alkenes and alkynes: A density functional study
2006-01-01 Coletti, Cecilia; Marrone, Alessandro; Giorgi, G; Sgamellotti, A; Cerofolini, G; Re, Nazzareno
Separazione mediante cromatografia liquida ad alta efficienza in isocratica di analiti polari e apolari di interesse farmaceutico: confronto fra colonne
2007-01-01 Iuliani, Piera; Marrone, Alessandro; DI FEDERICO, LUCIA MARILENA; Luisi, Grazia; Colantonio, Patrizia; Carlucci, Giuseppe
``A DFT study of carboplatin aquation and its binding to DNA"
2007-01-01 Marrone, Alessandro; Coletti, Cecilia; N., Besker; N., Re
``A density functional study of antitumor active platinum complexes in trans geometry with a planar ligand"
2007-01-01 N., Re; Coletti, Cecilia; Marrone, Alessandro
Modeling of the GST inhibition: inclusion of protein flexibility by cross-docking
2007-01-01 F., Lannutti; Coletti, Cecilia; N., Besker; Marrone, Alessandro; Re, Nazzareno
``Antitumor active platinum complexes in trans geometry with a planar ligand: a theoretical study"
2007-01-01 Marrone, Alessandro; Coletti, Cecilia; N., Re
New Matrix Metalloproteinase Inhibitors Based on N-hydroxyurea as zinc-binding group: synthesis, biological evaluation and computational studies.
2007-01-01 Agamennone, Mariangela; Campestre, Cristina; Chiappini, Marika; A., Laghezza; Marrone, Alessandro; Re, Nazzareno; Tortorella, Paolo; Gallina, Carlo
Binding of antitumor ruthenium complexes to DNA and proteins: A theoretical approach
2007-01-01 Besker, N; Coletti, Cecilia; Marrone, Alessandro; Re, Nazzareno
Local and non-local properties controlling the strength of Bronsted acids and bases
2007-01-01 Cerofolini, Gf; Marrone, Alessandro; Re, Nazzareno
Syntesis and pharmacological evaluation of fibrates analogues as cardiovascular agents
2008-01-01 DE FILIPPIS, Barbara; Ammazzalorso, Alessandra; Amoroso, Rosa; Bettoni, Giancarlo; Fantacuzzi, Marialuigia; Giampietro, Letizia; Giancristofaro, Antonella; Lannutti, Fabio; Maccallini, Cristina; Marrone, Alessandro; Moschetta, A.
Insight into the mechanism of aquation of the Ruthenium based anticancer drug NAMI-A: a Density Functional study
2008-01-01 N., Besker; Coletti, Cecilia; Marrone, Alessandro; Re, Nazzareno
“A Dissociative Route to C-H Bond Activation in a Biphenyl Platinum(II) Complex: A Kinetic and DFT study”
2008-01-01 A, ; Marrone, Alessandro; M. R, Plutino; N., Re; R., Romeo
Yonemitsu-type condensations promoted by TiCl4: a combined DFT and experimental investigation
2008-01-01 A., Renzetti; Marrone, Alessandro; S., Gérard; N., Re; P., DE MARIA; Fontana, Antonella; J., Sapi
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