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Analysis of the mechanism of alliin and allicin against SARS-CoV-2S/ACE2 and SARS-CoV-2 Mpro based on molecular docking and molecular dynamics

Tianjiao Li, Bijun Cheng. Analysis of the mechanism of alliin and allicin against SARS-CoV-2S/ACE2 and SARS-CoV-2 Mpro based on molecular docking and molecular dynamics. In Proceedings of the 2023 4th International Symposium on Artificial Intelligence for Medicine Science, ISAIMS 2023, Chengdu, China, October 20-22, 2023. pages 1325-1331, ACM, 2023. [doi]

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