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Items: 1 to 20 of 44

1.

Solvent dependency of the UV-Vis spectrum of indenoisoquinolines: role of keto-oxygens as polarity interaction probes.

Coletta A, Castelli S, Chillemi G, Sanna N, Cushman M, Pommier Y, Desideri A.

PLoS One. 2013 Sep 26;8(9):e73881. doi: 10.1371/journal.pone.0073881. eCollection 2013.

2.

WEP: a high-performance analysis pipeline for whole-exome data.

D'Antonio M, D'Onorio De Meo P, Paoletti D, Elmi B, Pallocca M, Sanna N, Picardi E, Pesole G, Castrignan├▓ T.

BMC Bioinformatics. 2013;14 Suppl 7:S11. doi: 10.1186/1471-2105-14-S7-S11. Epub 2013 Apr 22.

3.

Dynamical age differences among coeval star clusters as revealed by blue stragglers.

Ferraro FR, Lanzoni B, Dalessandro E, Beccari G, Pasquato M, Miocchi P, Rood RT, Sigurdsson S, Sills A, Vesperini E, Mapelli M, Contreras R, Sanna N, Mucciarelli A.

Nature. 2012 Dec 20;492(7429):393-5. doi: 10.1038/nature11686.

PMID:
23257880
4.

Oxygen adsorption on ╬▓-quartz model surfaces: some insights from density functional theory calculations and semiclassical time-dependent dynamics.

Zazza C, Rutigliano M, Sanna N, Barone V, Cacciatore M.

J Phys Chem A. 2012 Mar 8;116(9):1975-83. doi: 10.1021/jp205517j. Epub 2012 Feb 22.

PMID:
22295901
5.

Mutations in ORC1, encoding the largest subunit of the origin recognition complex, cause microcephalic primordial dwarfism resembling Meier-Gorlin syndrome.

Bicknell LS, Walker S, Klingseisen A, Stiff T, Leitch A, Kerzendorfer C, Martin CA, Yeyati P, Al Sanna N, Bober M, Johnson D, Wise C, Jackson AP, O'Driscoll M, Jeggo PA.

Nat Genet. 2011 Feb 27;43(4):350-5. doi: 10.1038/ng.776.

PMID:
21358633
6.

Conformational analysis and UV/Vis spectroscopic properties of a rotaxane-based molecular machine in acetonitrile dilute solution: when simulations meet experiments.

Mancini G, Zazza C, Aschi M, Sanna N.

Phys Chem Chem Phys. 2011 Feb 14;13(6):2342-9. doi: 10.1039/c0cp01773f. Epub 2010 Dec 6.

PMID:
21132200
7.

Assignment of UV-vis spectrum of (3,3')-diindolylmethane, a Leishmania donovani topoisomerase IB inhibitor and a candidate DNA minor groove binder.

Coletta A, Morozzo della Rocca B, Jaisankar P, Majumder HK, Chillemi G, Sanna N, Desideri A.

J Phys Chem A. 2010 Jul 8;114(26):7121-6. doi: 10.1021/jp101494d.

PMID:
20550156
8.

Structural and dynamical effects induced by the anticancer drug topotecan on the human topoisomerase I - DNA complex.

Mancini G, D'Annessa I, Coletta A, Sanna N, Chillemi G, Desideri A.

PLoS One. 2010 Jun 3;5(6):e10934. doi: 10.1371/journal.pone.0010934.

9.

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.

Zazza C, Coletta A, Sanna N, Chillemi G, Mancini G, Desideri A.

J Phys Chem B. 2010 May 27;114(20):6770-8. doi: 10.1021/jp1015824.

PMID:
20438088
10.

Computational study on compound I redox-active species in horseradish peroxydase enzyme: conformational fluctuations and solvation effects.

Zazza C, Palma A, Sanna N, Tatoli S, Aschi M.

J Phys Chem B. 2010 May 27;114(20):6817-24. doi: 10.1021/jp101033w.

PMID:
20438084
11.

A fast redox-induced switching mechanism in a conformationally controllable molecular thread in solution.

Zazza C, Mancini G, Amadei A, Sanna N, Aschi M.

Phys Chem Chem Phys. 2010 May 14;12(18):4552-4. doi: 10.1039/b926627e. Epub 2010 Mar 5.

PMID:
20428532
12.

Photoabsorption spectra of a natural polyphenol compound for therapeutic applications: the protocatechuic acid in dilute water solution at room temperature.

Zazza C, Sanna N.

Phys Chem Chem Phys. 2010 Apr 21;12(15):3859-63. doi: 10.1039/b925237a. Epub 2010 Feb 24.

PMID:
20358080
13.

Oxygen adsorption on beta-cristobalite polymorph: ab initio modeling and semiclassical time-dependent dynamics.

Rutigliano M, Zazza C, Sanna N, Pieretti A, Mancini G, Barone V, Cacciatore M.

J Phys Chem A. 2009 Dec 31;113(52):15366-75. doi: 10.1021/jp9066026.

PMID:
19845325
14.

In silico characterization of a fourfold magnesium organometallic compound in PTCDA thin films.

Zazza C, Sanna N, Palma A.

J Phys Chem A. 2009 Dec 31;113(52):14813-7. doi: 10.1021/jp904940e.

PMID:
19788293
15.

Female boxing in Italy: 2002-2007 report.

Bianco M, Sanna N, Bucari S, Fabiano C, Palmieri V, Zeppilli P.

Br J Sports Med. 2011 Jun;45(7):563-70. doi: 10.1136/bjsm.2009.061135. Epub 2009 Aug 19. Erratum in: Br J Sports Med. 2012 Nov;46(14):1023. Massimiliano, Bianco [corrected to Bianco, Massimiliano]; Nicola, Sanna [corrected to Sanna, Nicola]; Sante, Bucari [corrected to Bucari, Sante]; Carmela, Fabiano [corrected to Fabiano, Carmela]; Palmieri, V [corrected to Palmieri, Vincenzo]; Paolo, Zeppilli [corrected to Zeppilli, Paolo].

PMID:
19696035
16.

UV-vis spectra of the anticancer camptothecin family drugs in aqueous solution: specific spectroscopic signatures unraveled by a combined computational and experimental study.

Sanna N, Chillemi G, Gontrani L, Grandi A, Mancini G, Castelli S, Zagotto G, Zazza C, Barone V, Desideri A.

J Phys Chem B. 2009 Apr 23;113(16):5369-75. doi: 10.1021/jp809801y.

PMID:
19334673
17.

The role of arginine 38 in horseradish peroxidase enzyme revisited: a computational investigation.

Tatoli S, Zazza C, Sanna N, Palma A, Aschi M.

Biophys Chem. 2009 Apr;141(1):87-93. doi: 10.1016/j.bpc.2008.12.015. Epub 2009 Jan 15.

PMID:
19178992
18.

Can a synthetic thread act as an electrochemically switchable molecular device?

Zazza C, Amadei A, Sanna N, Aschi M.

Chem Commun (Camb). 2008 Aug 7;(29):3399-401. doi: 10.1039/b804031a. Epub 2008 Jun 19.

PMID:
18633502
19.

Ring-breaking electron attachment to uracil: following bond dissociations via evolving resonances.

Gianturco FA, Sebastianelli F, Lucchese RR, Baccarelli I, Sanna N.

J Chem Phys. 2008 May 7;128(17):174302. doi: 10.1063/1.2913169. Erratum in: J Chem Phys. 2009 Dec 28;131(24):249901.

PMID:
18465917
20.

Structural and dynamical properties of the Hg2+ aqua ion: a molecular dynamics study.

Mancini G, Sanna N, Barone V, Migliorati V, D'Angelo P, Chillemi G.

J Phys Chem B. 2008 Apr 17;112(15):4694-702. doi: 10.1021/jp074545s. Epub 2008 Mar 27.

PMID:
18366205

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