Potential inhibitors of SARS-CoV-2 (COVID 19) proteases PLpro and Mpro/ 3CLpro: molecular docking and simulation studies of three pertinent medicinal plant natural components.

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作者： Devvret,Verma ^[1] ; Debasis,Mitra ^[2] ; Manish,Paul ^[3] ; Priya,Chaudhary ^[4] ; Anshul,Kamboj ^[1] ; Hrudayanath,Thatoi ^[3] ; Pracheta,Janmeda ^[4] ; Divya,Jain ^[4] ; Periyasamy,Panneerselvam ^[5] ; Rakesh,Shrivastav ^[6] ; Kumud,Pant ^[1] ; Pradeep K,Das Mohapatra ^[2]

作者单位： Department of Biotechnology, Graphic Era (Deemed to be University), Dehradun, 248 002, Uttarakhand, India. ^[1] Department of Microbiology, Raiganj University, Raiganj, 733 134, Uttar Dinajpur, West Bengal, India. ^[2] Department of Biotechnology, Maharaja Sriram Chandra Bhanja Deo University, Baripada, 757003, Odisha, India. ^[3] Department of Bioscience and Biotechnology, Banasthali University, Vanasthali, 304022, Rajasthan, India. ^[4] Microbiology, Crop Production Division, ICAR- National Rice Research Institute, Cuttack, 753 006, Odisha, India. ^[5] Department of Applied Sciences, NGF College of Engineering and Technology, Palwal, Haryana, India. ^[6] PAKB Environment Conservation Centre, Raiganj University, Raiganj, 733 134, Uttar Dinajpur, West Bengal, India. ^[7]

关键词 Canthin-6-one 9-O-Beta-glucopyranoside Molecular dynamics Natural inhibitor PLpro-Mpro/3CLpro SARS-CoV-2 (COVID-19)

DOI 10.1016/j.crphar.2021.100038

PMID 34870149

发布时间 2021-12-07

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Current research in pharmacology and drug discovery

2021年2卷

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Potential inhibitors of SARS-CoV-2 (COVID 19) proteases PL<sup>pro</sup> and M<sup>pro</sup>/ 3CL<sup>pro</sup>: molecular docking and simulation studies of three pertinent medicinal plant natural components.

Current research in pharmacology and drug discovery

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Current research in pharmacology and drug discovery

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Potential inhibitors of SARS-CoV-2 (COVID 19) proteases PL<sup>pro</sup> and M<sup>pro</sup>/ 3CL<sup>pro</sup>: molecular docking and simulation studies of three pertinent medicinal plant natural components.

Current research in pharmacology and drug discovery

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Current research in pharmacology and drug discovery

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