Publications by authors named "Giada Ciardullo"

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The Effect of Chalcogen-Chalcogen Bond Formation in the New Delhi Metallo-β-Lactamase 1 Enzyme to Counteract Antibiotic Resistance.
Giada Ciardullo, Mario Prejanò, Angela Parise, Nino Russo, Tiziana Marino

J Chem Theory Comput· February 2025

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On the dual role of (+)-catechin as primary antioxidant and inhibitor of viral proteases.
Giada Ciardullo, Carla Orlando, Nino Russo, Emanuela Marchese, Annia Galano

Comput Biol Med· September 2024

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Viral RNA Replication Suppression of SARS-CoV-2: Atomistic Insights into Inhibition Mechanisms of RdRp Machinery by ddhCTP.
Giada Ciardullo, Angela Parise, Mario Prejanò, Tiziana Marino

J Chem Inf Model· March 2024

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Incorporation of -Platinated Guanines into Thermus Aquaticus (Taq) DNA Polymerase: Atomistic Insights from Molecular Dynamics Simulations.
Federica De Castro, Giada Ciardullo, Francesco Paolo Fanizzi, Mario Prejanò, Michele Benedetti

Int J Mol Sci· June 2023

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Computational investigation on the antioxidant activities and on the M SARS-CoV-2 non-covalent inhibition of isorhamnetin.
Maciej Spiegel, Giada Ciardullo, Tiziana Marino, Nino Russo

Front Chem· January 2023

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On the Recognition of Natural Substrate CTP and Endogenous Inhibitor ddhCTP of SARS-CoV-2 RNA-Dependent RNA Polymerase: A Molecular Dynamics Study.
Angela Parise, Giada Ciardullo, Mario Prejanò, Aurélien de la Lande, Tiziana Marino

J Chem Inf Model· October 2022

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