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Decrypting the allosteric network: multi-scale dynamics of SARS-CoV-2 main protease inhibition by Moringa oleifera flavonoids

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The SARS-CoV-2 main protease (Mpro) is a prototypical enzyme whose activity is governed by long-range allosteric communication within its dynamic structural network. Flavonoids from Moringa oleifera have been reported to interact with Mpro, yet the dynamic mec... ...