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Identification of Food Compounds as inhibitors of SARS-CoV-2 main protease using molecular docking and molecular dynamics simulations

SARS-CoV-2 has rapidly emerged as a global pandemic with high infection rate. At present, there is no drug available for this deadly disease. Recently, M(pro) (Main Protease) enzyme has been identified as essential proteins for the survival of this virus. In the present work, Lipinski's rules a...

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書誌詳細
出版年:Chemometr Intell Lab Syst
主要な著者: Masand, Vijay H., Sk, Md Fulbabu, Kar, Parimal, Rastija, Vesna, Zaki, Magdi E.A.
フォーマット: Artigo
言語:Inglês
出版事項: Elsevier B.V. 2021
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC8295492/
https://ncbi.nlm.nih.gov/pubmed/34312571
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.chemolab.2021.104394
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