Quantum Mechanical Predictions of the Antioxidant Capability of Moracin C Isomers

by Angela Parise, Angela Parise, Bruna Clara De Simone, Tiziana Marino, Marirosa Toscano, Nino Russo
Published 2021-04-01

The Se–S Bond Formation in the Covalent Inhibition Mechanism of SARS-CoV-2 Main Protease by Ebselen-like Inhibitors: A Computational Study

by Angela Parise, Isabella Romeo, Nino Russo, Tiziana Marino
Published 2021-09-01

The Generation of the Oxidant Agent of a Mononuclear Nonheme Fe(II) Biomimetic Complex by Oxidative Decarboxylation. A DFT Investigation

by Angela Parise, Maria Costanza Muraca, Nino Russo, Marirosa Toscano, Tiziana Marino
Published 2020-01-01

The Antioxidant Capability of Higenamine: Insights from Theory

by Isabella Romeo, Angela Parise, Annia Galano, Nino Russo, Juan Raúl Alvarez-Idaboy, Tiziana Marino
Published 2020-04-01