Nino Russo

Publication Activity (10 Years)

Years Active: 1995-2024
Publications (10 Years): 13

Top Topics

Molecular Dynamics Simulations

Multiple Targets

Myocardial Infarction

Top Venues

J. Comput. Chem.

J. Chem. Inf. Model.

Comput. Biol. Medicine

Publications

Giada Ciardullo, Carla Orlando, Nino Russo, Emanuela Marchese, Annia Galano, Tiziana Marino, Mario Prejanò
On the dual role of (+)-catechin as primary antioxidant and inhibitor of viral proteases. Comput. Biol. Medicine 180 (2024)
Wichien Sang-aroon, Marta Erminia Alberto, Marirosa Toscano, Nino Russo
Chalcogen atom effect on the intersystem crossing kinetic constant of oxygen- and sulfur disubstituted heteroporphyrins. J. Comput. Chem. 45 (16) (2024)
Alessandra G. Ritacca, Mario Prejanò, Marta Erminia Alberto, Tiziana Marino, Marirosa Toscano, Nino Russo
On the antibacterial photodynamic inactivation mechanism of Emodin and Dermocybin natural photosensitizers: A theoretical investigation. J. Comput. Chem. 45 (15) (2024)
Bruna Clara De Simone, Gloria Mazzone, Marirosa Toscano, Nino Russo
On the origin of photodynamic activity of hypericin and its iodine-containing derivatives. J. Comput. Chem. 43 (30) (2022)
Bruna Clara De Simone, Marta Erminia Alberto, Nino Russo, Marirosa Toscano
Photophysical properties of heavy atom containing tetrasulfonyl phthalocyanines as possible photosensitizers in photodynamic therapy. J. Comput. Chem. 42 (25) (2021)
Alessandra G. Ritacca, Ida Ritacco, Eslam Dabbish, Nino Russo, Gloria Mazzone, Emilia Sicilia
A Boron-Containing Compound Acting on Multiple Targets Against Alzheimer's Disease. Insights from Ab Initio and Molecular Dynamics Simulations. J. Chem. Inf. Model. 61 (7) (2021)
Mario Prejanò, Isabella Romeo, Maria Antonietta La Serra, Nino Russo, Tiziana Marino
Computational Study Reveals the Role of Water Molecules in the Inhibition Mechanism of LAT1 by 1, 2, 3-Dithiazoles. J. Chem. Inf. Model. 61 (12) (2021)
Marta Erminia Alberto, Bruna Clara De Simone, Simona Liuzzi, Tiziana Marino, Nino Russo, Marirosa Toscano
Iodine substituted phosphorus corrole complexes as possible photosensitizers in photodynamic therapy: Insights from theory. J. Comput. Chem. 41 (14) (2020)
Awatef Hattab, Zoubeida Dhaouadi, Alhadji Malloum, Jean Jules Fifen, Souad Lahmar, Nino Russo, Emilia Sicilia
Structures, binding energies, temperature effects, infrared spectroscopy of [Mg(NH3)n = 1-10]+ clusters from DFT and MP2 investigations. J. Comput. Chem. 40 (18) (2019)
Diego Cesario, Mariagrazia Fortino, Tiziana Marino, Francesca Nunzi, Nino Russo, Emilia Sicilia
The role of the halogen bond in iodothyronine deiodinase: Dependence on chalcogen substitution in naphthyl-based mimetics. J. Comput. Chem. 40 (8) (2019)
Chiara Ricca, Frédéric Labat, Claudia Zavala, Nino Russo, Carlo Adamo, Gabriel Merino, Emilia Sicilia
B, N-Codoped graphene as catalyst for the oxygen reduction reaction: Insights from periodic and cluster DFT calculations. J. Comput. Chem. 39 (11) (2018)
Jenny Pirillo, Gloria Mazzone, Nino Russo, Luca Bertini
Photophysical Properties of S, Se and Te-Substituted Deoxyguanosines: Insight into Their Ability To Act as Chemotherapeutic Agents. J. Chem. Inf. Model. 57 (2) (2017)
Gloria Mazzone, Annia Galano, Juan Raúl Alvarez-Idaboy, Nino Russo
Coumarin-Chalcone Hybrids as Peroxyl Radical Scavengers: Kinetics and Mechanisms. J. Chem. Inf. Model. 56 (4) (2016)
Tiziana Marino, Nino Russo, Emilia Sicilia, Marirosa Toscano
Some examples on the performance of density functional theory in the description of bioinorganic systems and processes. BIBE (2015)
Marta Erminia Alberto, Gloria Mazzone, Angelo Domenico Quartarolo, Flavio Fortes Ramos Sousa, Emilia Sicilia, Nino Russo
Electronic spectra and intersystem spin-orbit coupling in 1, 2- and 1, 3-squaraines. J. Comput. Chem. 35 (29) (2014)
Marta Erminia Alberto, Cristina Iuga, Angelo Domenico Quartarolo, Nino Russo
Bisanthracene Bis(dicarboxylic imide)s as Potential Photosensitizers in Photodynamic Therapy: A Theoretical Investigation. J. Chem. Inf. Model. 53 (9) (2013)
Angelo Domenico Quartarolo, Sandro Giuseppe Chiodo, Nino Russo
A TDDFT investigation of bay substituted perylenediimides: Absorption and intersystem crossing. J. Comput. Chem. 33 (11) (2012)
Sandro Chiodo, Nino Russo
One-electron spin-orbit contribution by effective nuclear charges. J. Comput. Chem. 30 (5) (2009)
Gennady N. Chuev, Maxim V. Fedorov, Sandro Chiodo, Nino Russo, Emilia Sicilia
Hydration of ionic species studied by the reference interaction site model with a repulsive bridge correction. J. Comput. Chem. 29 (14) (2008)
Sandro Chiodo, Nino Russo
Determination of spin-orbit coupling contributions in the framework of density functional theory. J. Comput. Chem. 29 (6) (2008)
Ivan Rivalta, Nino Russo, Emilia Sicilia
Methane activation by chromium oxide cations in the gas phase: A theoretical study. J. Comput. Chem. 27 (2) (2006)
Maria Del Carmen Michelini, Nino Russo, Mohammad Esmaïl Alikhani, Bernard Silvi
Energetic and topological analyses of the oxidation reaction between Mon (n = 1, 2) and N2O. J. Comput. Chem. 26 (12) (2005)
Sandro Chiodo, Nino Russo, Emilia Sicilia
Newly developed basis sets for density functional calculations. J. Comput. Chem. 26 (2) (2005)
Maria Del Carmen Michelini, Nino Russo, Mohammad Esmaïl Alikhani, Bernard Silvi
Energetic and topological analysis of the reaction of Mo and Mo2 with NH3, C2H2, and C2H4 molecules. J. Comput. Chem. 25 (13) (2004)
Mihai V. Putz, Nino Russo, Emilia Sicilia
On the applicability of the HSAB principle through the use of improved computational schemes for chemical hardness evaluation. J. Comput. Chem. 25 (7) (2004)
Corinne Lacaze-Dufaure, Tzonka Mineva, Nino Russo
On the interaction of Mo and Mo2 with NH3, C2H4, and C3H6 . J. Comput. Chem. 22 (13) (2001)
Nino Russo, Marirosa Toscano, André Grand
Theoretical determination of electron affinity and ionization potential of DNA and RNA bases. J. Comput. Chem. 21 (14) (2000)
Tzonka Mineva, Nino Russo, Emilia Sicilia
Solvation effects on reaction profiles by the polarizable continuum model coupled with the Gaussian density functional method. J. Comput. Chem. 19 (3) (1998)
Nino Russo, Marirosa Toscano, André Grand, Franck Jolibois
Protonation of thymine, cytosine, adenine, and guanine DNA nucleic acid bases: Theoretical investigation into the framework of density functional theory. J. Comput. Chem. 19 (9) (1998)
Piercarlo Fantucci, Tiziana Marino, Nino Russo, Anna Maria Villa
Conformational behaviour of the antineoplastic peptide dolastatin-10 and of two mutated derivatives. J. Comput. Aided Mol. Des. 9 (5) (1995)