Elucidating Atomistic Insight into the Dynamical Responses of the SARS-CoV-2 Main Protease for the Binding of Remdesivir Analogues: Leveraging Molecular Mechanics To Decode the Inhibition Mechanism - researchr publication authors

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Pabitra Narayan Samanta, Devashis Majumdar, Jerzy Leszczynski. Elucidating Atomistic Insight into the Dynamical Responses of the SARS-CoV-2 Main Protease for the Binding of Remdesivir Analogues: Leveraging Molecular Mechanics To Decode the Inhibition Mechanism. Journal of Chemical Information and Computer Sciences, 63(11):3404-3422, June 2023. [doi]

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