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. 2021 Mar 20;105:107904. doi: 10.1016/j.jmgm.2021.107904

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Fig. 5 — Evaluated MM/GBSA binding energy per frame for PubChem-129-716-607 (in red), PubChem-885-071-27 (in blue) and rutin (in black) towards SARS-CoV-2 main protease (M^pro) over 150 ns MD simulations. (For interpretation of the references to colour in this figure legend, the reader is referred to the Web version of this article.)