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Sanna, Nico

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Full Name
Sanna, Nico
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Italy
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Publications

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Date Issued:  [2020 TO 2023]

Results 1-19 of 19 (Search time: 0.003 seconds).

Issue DateTitleAuthor(s)
12020Tunable approximations to control time-to-solution in an HPC molecular docking Mini-AppGadioli, D.; Silvano, C.; Palermo, G.; Cherubin, S.; Vitali, E.; Agosta, G.; Manelfi, C.; Beccari, Ar; Cavazzoni, C.; Sanna, Nico 
22020SCELib4.0: The new program version for computing molecular properties in the Single Center ApproachSanna, Nico ; Morelli, G.; Orlandini, S.; Tacconi, M.; Baccarelli, I.
32021On the proton-bound noble gas dimers (Ng-H-Ng)+ and (Ng-H-Ng')+ (Ng, Ng'= He-Xe): relationships between structure, stability, and bonding characterBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
42022Noble-gas compounds: A general procedure of bonding analysisBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
52021MXAN: A new program for ab-initio structural quantitative analysis of XANES experimentsBenfatto, Maurizio; Della Longa, Stefano; Pace, Elisabetta; Chillemi, Giovanni ; Padrin, Cristiano; Natoli, Calogero R.; Sanna, Nico 
62020Influence of incidence angle on hydrogen and deuterium atoms interaction with a cesiated surfaceRutigliano, M.; Palma, A.; Sanna, Nico 
72022How Computations Can Assist the Rational Design of Drugs for Photodynamic Therapy: Photosensitizing Activity Assessment of a Ru(II)-BODIPY AssemblyPonte, Fortuna; Scopelliti, Davide Maria; Sanna, Nico ; Sicilia, Emilia; Mazzone, Gloria
82021From LAr to L-ArBeO (L = He, Ne, Ar, HF): switching on σ-hole effects in non-covalent interactionsBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
92021Dispersion energy effects on oxygen interaction with cesiated molybdenum surfacesSanna, Nico ; Rutigliano, Maria; Palma, Amedeo
102021Concerning the role of σ-Hole in non-covalent interactions: insights from the study of the complexes of ArBeO with simple ligandsBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
112022Computational Exploration of the Synergistic Anticancer Effect of a Multi-Action Ru(II)-Pt(IV) ConjugateScoditti, Stefano; Mazzone, Gloria; Sanna, Nico ; Sicilia, Emilia
122020Complexes of the noble-gas atoms with unsaturated ions: A theoretical investigation on the exemplary (H<inf>2</inf>C = NH<inf>2</inf><sup>+</sup>)ArBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
132023Complexes of NgHNg+ (Ng = He, Ne, Ar) with He: Theoretical insights into structure, stability, and bonding characterBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
142020Complexes of helium with neutral molecules: Progress toward a quantitative scale of bonding characterBorocci, S.; Grandinetti, F.; Sanna, Nico ; Antoniotti, P.; Nunzi, F.
152020Complexes of helium with neutral molecules: Progress toward a quantitative scale of bonding characterBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico ; Antoniotti, Paola; Nunzi, Francesca
162020Classifying the chemical bonds involving the noble-gas atomsBorocci, Stefano ; Grandinetti, Felice ; Nunzi, Francesca; Sanna, Nico 
172022Benchmarking Plane Waves Quantum Mechanical Calculations of Iron(II) Tris(2,2<sup>′</sup>-bipyridine) Complex by X-ray Absorption SpectroscopySanna, Nico ; Benfatto, Maurizio
182021Altered Local Interactions and Long-Range Communications in UK Variant (B.1.1.7) Spike GlycoproteinBorocci, Stefano ; Cerchia, Carmen; Grottesi, Alessandro; Sanna, Nico ; Prandi, Ingrid Guarnetti; Abid, Nabil; Beccari, Andrea R; Chillemi, Giovanni ; Talarico, Carmine
192023A theoretical study of a light-powered artificial molecular motor in dichloromethane solution under equilibrium conditionszazza, costantino ; Borocci, Stefano ; Sanna, Nico