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Multi-conformation representation of Mpro identifies promising candidates for drug repurposing against COVID-19

The COVID-19 main protease (Mpro), one of the conserved proteins of the novel coronavirus is crucial for its replication and so is a very lucrative drug target. Till now, there is no drug molecule that has been convincingly identified as the inhibitor of the function of this protein. The current pan...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Veröffentlicht in:J Mol Model
Hauptverfasser: Paul, Debarati, Basu, Debadrita, Ghosh Dastidar, Shubhra
Format: Artigo
Sprache:Inglês
Veröffentlicht: Springer Berlin Heidelberg 2021
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC8052536/
https://ncbi.nlm.nih.gov/pubmed/33864532
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s00894-021-04732-1
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