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Journal of Biomolecular Structure and Dynamics Volume 40, 2022 - Issue 19
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Research Articles

Combined use of the hepatitis C drugs and amentoflavone could interfere with binding of the spike glycoprotein of SARS-CoV-2 to ACE2: the results of a molecular simulation study

Kateryna V. Miroshnychenkoa O. Ya. Usikov Institute for Radiophysics and Electronics of NAS of Ukraine, Kharkiv, UkraineCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0002-2543-6519
ORCID Icon &
Anna V. Shestopalovaa O. Ya. Usikov Institute for Radiophysics and Electronics of NAS of Ukraine, Kharkiv, Ukraine;b V. N. Karazin Kharkiv National University, Kharkiv, Ukraine
Pages 8672-8686 | Received 02 Jul 2020, Accepted 05 Apr 2021, Published online: 26 Apr 2021

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Tanushree Das & Chaitali Mukhopadhyay. (2023) Computational studies suggest compounds restoring function of p53 cancer mutants can bind SARS-CoV-2 spike protein. Journal of Biomolecular Structure and Dynamics 41:8, pages 3368-3381.
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Lucas Soares Frota, Daniela Ribeiro Alves, Márcia Machado Marinho, Leonardo Paes da Silva, Francisco Wagner de Queiroz Almeida Neto, Emmanuel Silva Marinho & Selene Maia de Morais. (2023) Antioxidant and anticholinesterase activities of amentoflavone isolated from Ouratea fieldingiana (Gardner) Engl. through in vitro and chemical-quantum studies. Journal of Biomolecular Structure and Dynamics 41:4, pages 1206-1216.
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Articles from other publishers (4)

Kaifu Gao, Rui Wang, Jiahui Chen, Limei Cheng, Jaclyn Frishcosy, Yuta Huzumi, Yuchi Qiu, Tom Schluckbier, Xiaoqi Wei & Guo-Wei Wei. (2022) Methodology-Centered Review of Molecular Modeling, Simulation, and Prediction of SARS-CoV-2. Chemical Reviews 122:13, pages 11287-11368.
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Xifeng Xiong, Nan Tang, Xudong Lai, Jinli Zhang, Weilun Wen, Xiaojian Li, Aiguo Li, Yanhua Wu & Zhihe Liu. (2021) Insights Into Amentoflavone: A Natural Multifunctional Biflavonoid. Frontiers in Pharmacology 12.
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Amal Mahmoud, Ahmed Mostafa, Ahmed A. Al-Karmalawy, Ahmad Zidan, Hamada S. Abulkhair, Sara H. Mahmoud, Mahmoud Shehata, Mahmoud M. Elhefnawi & Mohamed A. Ali. (2021) Telaprevir is a potential drug for repurposing against SARS-CoV-2: computational and in vitro studies. Heliyon 7:9, pages e07962.
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Vincent Binette, Sébastien Côté, Mohamed Haddad, Phuong Trang Nguyen, Sébastien Bélanger, Steve Bourgault, Charles Ramassamy, Roger Gaudreault & Normand Mousseau. (2021) Corilagin and 1,3,6-Tri- O -galloy-β- d -glucose: potential inhibitors of SARS-CoV-2 variants . Physical Chemistry Chemical Physics 23:27, pages 14873-14888.
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