Monari A - Search Results

1

Thermodynamics of the Interaction between the Spike Protein of Severe Acute Respiratory Syndrome Coronavirus-2 and the Receptor of Human Angiotensin-Converting Enzyme 2. Effects of Possible Ligands.

García-Iriepa C, Hognon C, Francés-Monerris A, Iriepa I, Miclot T, Barone G, Monari A, Marazzi M. García-Iriepa C, et al. Among authors: monari a. J Phys Chem Lett. 2020 Nov 5;11(21):9272-9281. doi: 10.1021/acs.jpclett.0c02203. Epub 2020 Oct 21. J Phys Chem Lett. 2020. PMID: 33085491

2

Benzophenone Ultrafast Triplet Population: Revisiting the Kinetic Model by Surface-Hopping Dynamics.

Marazzi M, Mai S, Roca-Sanjuán D, Delcey MG, Lindh R, González L, Monari A. Marazzi M, et al. Among authors: monari a. J Phys Chem Lett. 2016 Feb 18;7(4):622-6. doi: 10.1021/acs.jpclett.5b02792. Epub 2016 Jan 29. J Phys Chem Lett. 2016. PMID: 26821061 Free PMC article.

3

Hydrogen abstraction by photoexcited benzophenone: consequences for DNA photosensitization.

Marazzi M, Wibowo M, Gattuso H, Dumont E, Roca-Sanjuán D, Monari A. Marazzi M, et al. Among authors: monari a. Phys Chem Chem Phys. 2016 Mar 21;18(11):7829-36. doi: 10.1039/c5cp07938a. Phys Chem Chem Phys. 2016. PMID: 26911193

4

Circular Dichroism of DNA G-Quadruplexes: Combining Modeling and Spectroscopy To Unravel Complex Structures.

Gattuso H, Spinello A, Terenzi A, Assfeld X, Barone G, Monari A. Gattuso H, et al. Among authors: monari a. J Phys Chem B. 2016 Mar 31;120(12):3113-21. doi: 10.1021/acs.jpcb.6b00634. Epub 2016 Mar 17. J Phys Chem B. 2016. PMID: 26943487

5

From non-covalent binding to irreversible DNA lesions: nile blue and nile red as photosensitizing agents.

Gattuso H, Besancenot V, Grandemange S, Marazzi M, Monari A. Gattuso H, et al. Among authors: monari a. Sci Rep. 2016 Jun 22;6:28480. doi: 10.1038/srep28480. Sci Rep. 2016. PMID: 27329409 Free PMC article.

6

Two-photon-absorption DNA sensitization via solvated electron production: unraveling photochemical pathways by molecular modeling and simulation.

Gattuso H, Dumont E, Marazzi M, Monari A. Gattuso H, et al. Among authors: monari a. Phys Chem Chem Phys. 2016 Jul 21;18(27):18598-606. doi: 10.1039/c6cp02592g. Epub 2016 Jun 27. Phys Chem Chem Phys. 2016. PMID: 27345613

7

Simulating the Electronic Circular Dichroism Spectra of Photoreversible Peptide Conformations.

Gattuso H, García-Iriepa C, Sampedro D, Monari A, Marazzi M. Gattuso H, et al. Among authors: monari a. J Chem Theory Comput. 2017 Jul 11;13(7):3290-3296. doi: 10.1021/acs.jctc.7b00163. Epub 2017 Jun 6. J Chem Theory Comput. 2017. PMID: 28548847

8

Photophysics of the Singlet Oxygen Sensor Green Chromophore: Self-Production of ¹O₂ Explained by Molecular Modeling.

Marazzi M, Besancenot V, Gattuso H, Lassalle HP, Grandemange S, Monari A. Marazzi M, et al. Among authors: monari a. J Phys Chem B. 2017 Aug 17;121(32):7586-7592. doi: 10.1021/acs.jpcb.7b04383. Epub 2017 Aug 4. J Phys Chem B. 2017. PMID: 28735538

9

Deciphering the photosensitization mechanisms of hypericin towards biological membranes.

Gattuso H, Marazzi M, Dehez F, Monari A. Gattuso H, et al. Among authors: monari a. Phys Chem Chem Phys. 2017 Aug 30;19(34):23187-23193. doi: 10.1039/c7cp03723f. Phys Chem Chem Phys. 2017. PMID: 28820528

10

Ab initio molecular dynamics of thiophene: the interplay of internal conversion and intersystem crossing.

Schnappinger T, Kölle P, Marazzi M, Monari A, González L, de Vivie-Riedle R. Schnappinger T, et al. Among authors: monari a. Phys Chem Chem Phys. 2017 Sep 27;19(37):25662-25670. doi: 10.1039/c7cp05061e. Phys Chem Chem Phys. 2017. PMID: 28905947

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