Discovery of TCMs and derivatives against the main protease of SARS-CoV-2 via high throughput screening, ADMET analysis, and inhibition assay in vitro

Author:

Qi Xinyu,Li Binglin,Omarini Alejandra B.,Gand MartinORCID,Zhang Xiaoli,Wang Jiao

Publisher

Elsevier BV

Subject

Inorganic Chemistry,Organic Chemistry,Spectroscopy,Analytical Chemistry

Reference31 articles.

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3. Molecular docking, validation, dynamics simulations, and pharmacokinetic prediction of natural compounds against the SARS-CoV-2 main-protease;C;J. Biomol. Struct. Dyn.,2020

4. “https://www.who.int/emergencies/diseases/novel-coronavirus-2019”.

5. SARS-CoV-2: vaccines in the pandemic era;Li;Mil. Med. Res.,2021

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