Sicilia E - Search Results

1

Solvation properties of N-substituted cis and trans amides are not identical: significant enthalpy and entropy changes are revealed by the use of variable temperature 1H NMR in aqueous and chloroform solutions and ab initio calculations.

Troganis AN, Sicilia E, Barbarossou K, Gerothanassis IP, Russo N. Troganis AN, et al. Among authors: sicilia e. J Phys Chem A. 2005 Dec 29;109(51):11878-84. doi: 10.1021/jp0537557. J Phys Chem A. 2005. PMID: 16366639

2

The current status in computational exploration of Pt(IV) prodrug activation by reduction.

Ponte F, Scoditti S, Mazzone G, Sicilia E. Ponte F, et al. Among authors: sicilia e. Phys Chem Chem Phys. 2023 Jun 15;25(23):15586-15599. doi: 10.1039/d3cp01150j. Phys Chem Chem Phys. 2023. PMID: 37259840 Review.

3

A detailed density functional theory exploration of the photodissociation mechanism of ruthenium complexes for photoactivated chemotherapy.

Belletto D, Ponte F, Mazzone G, Sicilia E. Belletto D, et al. Among authors: sicilia e. Dalton Trans. 2024 May 14;53(19):8243-8253. doi: 10.1039/d4dt00834k. Dalton Trans. 2024. PMID: 38654633

4

G-quadruplex DNA selective targeting for anticancer therapy: a computational study of a novel Pt^II monofunctional complex activated by adaptive binding.

Belletto D, Ponte F, Sanna N, Scoditti S, Sicilia E. Belletto D, et al. Among authors: sicilia e. Dalton Trans. 2023 Oct 3;52(38):13517-13527. doi: 10.1039/d3dt02678g. Dalton Trans. 2023. PMID: 37718620

5

Insights on cyclophosphamide metabolism and anticancer mechanism of action: A computational study.

Dabbish E, Scoditti S, Shehata MNI, Ritacco I, Ibrahim MAA, Shoeib T, Sicilia E. Dabbish E, et al. Among authors: sicilia e. J Comput Chem. 2024 Apr 15;45(10):663-670. doi: 10.1002/jcc.27280. Epub 2023 Dec 13. J Comput Chem. 2024. PMID: 38088485

6

Anticancer Activity, Reduction Mechanism and G-Quadruplex DNA Binding of a Redox-Activated Platinum(IV)-Salphen Complex.

Vigna V, Scoditti S, Spinello A, Mazzone G, Sicilia E. Vigna V, et al. Among authors: sicilia e. Int J Mol Sci. 2022 Dec 8;23(24):15579. doi: 10.3390/ijms232415579. Int J Mol Sci. 2022. PMID: 36555221 Free PMC article.

7

Reaction of SC+(1D,3D) with H2O, NH3, and CH4: a density functional study.

Russo N, Sicilia E. Russo N, et al. Among authors: sicilia e. J Am Chem Soc. 2001 Mar 21;123(11):2588-96. doi: 10.1021/ja000658c. J Am Chem Soc. 2001. PMID: 11456928

8

Theoretical study of ammonia and methane activation by first-row transition metal cations M(+) (M = Ti, V, Cr).

Sicilia E, Russo N. Sicilia E, et al. J Am Chem Soc. 2002 Feb 20;124(7):1471-80. doi: 10.1021/ja0112487. J Am Chem Soc. 2002. PMID: 11841317

9

On the hardness evaluation in solvent for neutral and charged systems.

De Luca G, Sicilia E, Russo N, Mineva T. De Luca G, et al. Among authors: sicilia e. J Am Chem Soc. 2002 Feb 20;124(7):1494-9. doi: 10.1021/ja0116977. J Am Chem Soc. 2002. PMID: 11841320

10

Reaction of bare VO+ and FeO+ with ammonia: a theoretical point of view.

Chiodo S, Kondakova O, Michelini Mdel C, Russo N, Sicilia E. Chiodo S, et al. Among authors: sicilia e. Inorg Chem. 2003 Dec 29;42(26):8773-82. doi: 10.1021/ic0348650. Inorg Chem. 2003. PMID: 14686857

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