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Virtual screening, ADMET prediction and dynamics simulation of potential compounds targeting the main protease of SARS-CoV-2

The coronavirus disease-2019 caused by a novel SARS CoV-2 virus has emerged as a global threat. Still, no drugs are available for its treatment. The main protease is the most conserved structure responsible for the posttranslational processing of non-structural polyproteins of this virus. Therefore,...

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Bibliografiske detaljer
Udgivet i:J Biomol Struct Dyn
Main Authors: Yadav, Rohitash, Imran, Mohammed, Dhamija, Puneet, Chaurasia, Dheeraj Kumar, Handu, Shailendra
Format: Artigo
Sprog:Inglês
Udgivet: Taylor & Francis 2020
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7441774/
https://ncbi.nlm.nih.gov/pubmed/32715956
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1080/07391102.2020.1796812
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