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Journal of Biomolecular Structure and Dynamics Volume 40, 2022 - Issue 11
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Research Articles

Dual inhibition of SARS-CoV-2 spike and main protease through a repurposed drug, rutin

Anchala Kumaria School of Biotechnology, Jawaharlal Nehru University (JNU), New Delhi, India;b Department of Biotechnology, Teri School of Advanced Studies, New Delhi, IndiaCorrespondence[email protected]
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Vikrant Singh Rajputa School of Biotechnology, Jawaharlal Nehru University (JNU), New Delhi, IndiaCorrespondence[email protected]
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Priya Nagpala School of Biotechnology, Jawaharlal Nehru University (JNU), New Delhi, IndiaView further author information
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Himanshi Kukretya School of Biotechnology, Jawaharlal Nehru University (JNU), New Delhi, IndiaView further author information
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Sonam Groverc JH-Institute of Molecular Medicine, Jamia Hamdard, New Delhi, IndiaView further author information
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Abhinav Grovera School of Biotechnology, Jawaharlal Nehru University (JNU), New Delhi, IndiaCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0002-3296-7860View further author information
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Pages 4987-4999 | Received 02 Jun 2020, Accepted 10 Dec 2020, Published online: 27 Dec 2020

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Debanjan Sen, Samhita Bhaumik, Pradip Debnath & Sudhan Debnath. (2022) Potentiality of Moringa oleifera against SARS-CoV-2: identified by a rational computer aided drug design method. Journal of Biomolecular Structure and Dynamics 40:16, pages 7517-7534.
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T. S. Prathima, Md. Gulzar Ahmad, Ramanathan Karuppasamy, Kaushik Chanda & M. M. Balamurali. (2023) Investigation on Phyto‐active Constituent of Clerodendrum paniculatum as Therapeutic Agent against Viral Diseases . ChemistrySelect 8:4.
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Douglas B. Kell & Etheresia Pretorius. (2022) The potential role of ischaemia–reperfusion injury in chronic, relapsing diseases such as rheumatoid arthritis, Long COVID, and ME/CFS: evidence, mechanisms, and therapeutic implications. Biochemical Journal 479:16, pages 1653-1708.
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Ileana Miclea. (2022) Secondary Metabolites with Biomedical Applications from Plants of the Sarraceniaceae Family. International Journal of Molecular Sciences 23:17, pages 9877.
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Ivan Kreft, Mateja Germ, Aleksandra Golob, Blanka Vombergar, Francesco Bonafaccia & Zlata Luthar. (2022) Impact of Rutin and Other Phenolic Substances on the Digestibility of Buckwheat Grain Metabolites. International Journal of Molecular Sciences 23:7, pages 3923.
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Vishma Pratap Sur, Madhab Kumar Sen & Katerina Komrskova. (2021) In Silico Identification and Validation of Organic Triazole Based Ligands as Potential Inhibitory Drug Compounds of SARS-CoV-2 Main Protease. Molecules 26:20, pages 6199.
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Pratibha Pandey, Fahad Khan, Faisal Abdulrahman Alzahrani, Huda A. Qari & Mohammad Oves. (2021) A Novel Approach to Unraveling the Apoptotic Potential of Rutin (Bioflavonoid) via Targeting Jab1 in Cervical Cancer Cells. Molecules 26:18, pages 5529.
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Kwang-Eun Choi, Jeong-Min Kim, JeeEun Rhee, Ae Kyung Park, Eun-Jin Kim & Nam Sook Kang. (2021) Molecular Dynamics Studies on the Structural Characteristics for the Stability Prediction of SARS-CoV-2. International Journal of Molecular Sciences 22:16, pages 8714.
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Bruno Rizzuti, Fedora Grande, Filomena Conforti, Ana Jimenez-Alesanco, Laura Ceballos-Laita, David Ortega-Alarcon, Sonia Vega, Hugh T. Reyburn, Olga Abian & Adrian Velazquez-Campoy. (2021) Rutin Is a Low Micromolar Inhibitor of SARS-CoV-2 Main Protease 3CLpro: Implications for Drug Design of Quercetin Analogs. Biomedicines 9:4, pages 375.
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