Noncovalent SARS-COV-2 main protease inhibitors: A virtual screening and molecular dynamic simulation study

Author:

Yan AoxiangORCID,Li Wei,Zhao Xu,Cao Ruiyuan,Li Hua,Chen Lixia,Li Xingzhou

Publisher

Elsevier BV

Reference42 articles.

1. Weekly epidemiological update on COVID-19, https://www.who.int/publications/m/item/weekly-epidemiological-update-on-covid-19---30-august-2023, [accessed 4 December 2023]; 2023.

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3. Functional assessment of cell entry and receptor usage for SARS-CoV-2 and other lineage B betacoronaviruses;Letko;Nat. Microbiol.,2020

4. Structure-guided design of potent inhibitors of SARS-CoV-2 3CL protease: structural, biochemical, and cell-based studies;Dampalla;J. Med. Chem.,2021

5. Machine learning prediction of 3CLpro SARS-CoV-2 docking scores;Bucinsky;Comp Biol Chem.,2022

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