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Journal of Biomolecular Structure and Dynamics Volume 41, 2023 - Issue 18
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Research Articles

Inhibition of the predicted allosteric site of the SARS-CoV-2 main protease through flavonoids

Bibi Kubraa Department of Chemistry, Islamia College University Peshawar, Peshawar, Pakistan
,
Syed Lal Badshaha Department of Chemistry, Islamia College University Peshawar, Peshawar, PakistanCorrespondence[email protected]
,
Shah Faisala Department of Chemistry, Islamia College University Peshawar, Peshawar, Pakistan
,
Mohamed Sharafb Department of Biochemistry and Molecular Biology, College of Marine Life Sciences, Ocean University of China, Qingdao, PR China
,
Abdul-Hamid Emwasc Core Labs, King Abdullah University of Science and Technology (KAUST), Thuwal, Saudi Arabia
,
Mariusz Jaremkod Smart-Health Initiative (SHI) and Red Sea Research Center (RSRC), Division of Biological and Environmental Sciences and Engineering (BESE), King Abdullah University of Science and Technology (KAUST), Thuwal, Saudi ArabiaCorrespondence[email protected]
&
Mohnad Abdallae Pediatric Research Institute, Children’s Hospital Affiliated to Shandong University, Jinan, Shandong, ChinaCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0002-1682-5547
ORCID Icon show all
Pages 9103-9120 | Received 23 May 2022, Accepted 19 Oct 2022, Published online: 20 Nov 2022

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Florbela Pereira, Loay Bedda, Mohamed A. Tammam, Abdul Kader Alabdullah, Reem Arafa & Amr El-Demerdash. (2023) Investigating the antiviral therapeutic potentialities of marine polycyclic lamellarin pyrrole alkaloids as promising inhibitors for SARS-CoV-2 and Zika main proteases (Mpro). Journal of Biomolecular Structure and Dynamics 0:0, pages 1-19.
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Urvashee Gogoi, Neelutpal Gogoi, Sanchaita Rajkhowa, Shah Alam Khan, Nisreen Daffa Alla Omer Hajedris, Nawal Al-Hoshani, Samia T. Al-Shouli & Aparoop Das. Expanding the therapeutic arsenal against cancer: a computational investigation of hybrid xanthone derivatives as selective Topoisomerase 2α ATPase inhibitors. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-30.
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Articles from other publishers (1)

Shah Faisal, Syed Lal Badshah, Bibi Kubra, Abdul-Hamid Emwas & Mariusz Jaremko. (2023) Alkaloids as potential antivirals. A comprehensive review. Natural Products and Bioprospecting 13:1.
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