Fragment-based in silico design of SARS-CoV-2 main protease inhibitors

3CLpro is essential for SARS-CoV-2 replication and infection; its inhibition using small molecules is a potential therapeutic strategy. In this study, a comprehensive crystallography-guided fragment-based drug discovery approach was employed to design new inhibitors for SARS-CoV-2 3CLpro. All small...

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Bibliographic Details
Main Authors: Ahmad, Sarfraz, Mirza, Muhammad Usman, Kee, Lee Yean, Nazir, Mamoona, Abdul Rahman, Noorsaadah, Trant, John F., Abdullah, Iskandar
Format: Article
Published: Wiley 2021
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Online Access:http://eprints.um.edu.my/28707/
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