Sfoglia per Autore
X-ray Absorption Studies on the N-terminal Copper-binding Region of Haemophilus ducreyi Cu, Zn Superoxide Dismutase
2005 D'Angelo, P; Pacello, F; Mancini, Giordano; Proux, O; HAZEMANN J., L; Desideri, A; Battistoni, A.
Combined X-ray absorption spectroscopy and Molecular Dynamics study of the Hg2+ aqua ion
2007 Mancini, Giordano; N., Sanna; Barone, Vincenzo; P., D'Angelo; G., Chillemi
Evidence for sevenfold coordination in the first solvation shell of Hg(II) aqua ion
2007 G., Chillemi; Mancini, Giordano; N., Sanna; Barone, Vincenzo; S., DELLA LONGA; M., Benfatto; N. V., Pavel; P., D'Angelo
Integrated experimental and theoretical approach for the structural characterization of Hg2+aqueous solutions
2008 P., D'Angelo; V., Migliorati; Mancini, Giordano; Barone, Vincenzo; G., Chillemi
A Coupled Molecular Dynamics and XANES Data Analysis Investigation of Aqueous Cadmium(II)
2008 D'Angelo, P; Migliorati, V; Mancini, Giordano; Chillemi, G.
Structural and dynamical properties of the Hg2+ aqua ion: a molecular dynamics study
2008 Mancini, Giordano; Sanna, Nico; Barone, Vincenzo; Migliorati, Valentina; Dangelo, Paola; Chillemi, Giovanni
Thermodynamic features and environmental effects in a two-states molecular device under strict electrochemical control
2009 Zazza, C; Mancini, Giordano; Sanna, N; M. ASCHI, M.
Molecular Modelling Of BCRP (ABCG2) Multidrug Resistance Protein And Docking Of New Camptothecin Analogues
2009 Grottesi, A; Mancini, Giordano; Desideri, A; Chillemi, G.
An amber compatible molecular mechanics force field for the anticancer drug topotecan
2009 Chillemi, G; Coletta, A; Mancini, Giordano; Sanna, N; Desideri, A.
Evidence of the crucial role of the linker domain on the catalytic activity of human topoisomerase I by experimental and simulative characterization of the Lys681Ala mutant
2009 Fiorani, P; Tesauro, C; Mancini, Giordano; Chillemi, G; D'Annessa, I; Graziani, G; Tentori, L; Muzi, A; Desideri, A.
Ion hydration in high-density water
2009 Migliorati, V; Chillemi, G; Mancini, Giordano; Zitolo, A; Tatoli, S; Filipponi, A; D'Angelo, P.
UV−Vis Spectra of the Anticancer Campothecin Family Drugs in Aqueous Solution: Specific Spectroscopic Signatures Unraveled by a Combined Computational and Experimental Study
2009 N., Sanna; G., Chillemi; L., Gontrani; A., Grandi; Mancini, Giordano; S., Castelli; G., Zagotto; C., Zazza; Barone, Vincenzo; A., Desideri
Structural Investigation of Lanthanoid Coordination: a Combined XANES and Molecular Dynamics Study
2009 Dangelo, P; Zitolo, A; Migliorati, V; Mancini, Giordano; Persson, I; Chillemi, G.
E-HEME STRUCTURE IN CU,ZN SUPEROXIDE DISMUTASE FROM HAEMOPHILUS DUCREYI BY X-RAY ABSORPTION SPECTROSCOPY. ARCHIVES OF BIOCHEMISTRY AND BIOPHYSICS
2010 Dangelo, P; Zitolo, A; Pacello, F; Mancini, Giordano; Proux, O; Hazemanne, J. L.; Desideri, D; Battistoni,
A fast redox-induced switching mechanism in a conformationally controllable molecular thread in solution
2010 Zazza, C; Mancini, Giordano; Amadei, A; Sanna, N; Aschi, M.
Solvent Effects on the Valence UV-VIS Absorption Spectra of Topotecan Anticancer Drug in Aqueous Solution at Room Temperature: A Nanoseconds Time-Scale TD-DFT/MD Computational Study
2010 Zazza, C; Coletta, A; Sanna, N; Chillemi, G; Mancini, Giordano; Desideri, A.
An X-ray diffraction and X-ray absorption spectroscopy joint study of neuroglobin
2010 Arcovito, A; Moschetti, T; D'Angelo, P; Mancini, Giordano; Vallone, B; Brunori, M; DELLA LONGA, S.
Structural and Dynamical Effects Induced by the Anticancer Drug Topotecan on the Human Topoisomerase I
2010 Mancini, Giordano; D'Annessa, I; Coletta, A; Sanna, N; Chillemi, G.
Hydration of diazoles in water solution: pyrazole. A theoretical and X-ray diffraction study.
2010 Ramondo, F; Tanzi, L; Campetella, M; Gontrani, L; Mancini, Giordano; Pieretti, A; Sadun, C.
Conformational analysis and UV/Vis spectroscopic properties of a rotaxane-based molecular machine in acetonitrile dilute solution: when simulations meet experiments
2010 Mancini, Giordano; Zazza, C; Aschi, M; Sanna, N.
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