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Elucidation of Cryptic and Allosteric Pockets within the SARS-CoV-2 Main Protease

The SARS-CoV-2 pandemic has rapidly spread across the globe, posing an urgent health concern. Many quests to computationally identify treatments against the virus rely on in silico small molecule docking to experimentally determined structures of viral proteins. One limit to these approaches is that...

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Bibliografiska uppgifter
I publikationen:J Chem Inf Model
Huvudupphovsmän: Sztain, Terra, Amaro, Rommie, McCammon, J. Andrew
Materialtyp: Artigo
Språk:Inglês
Publicerad: 2021
Ämnen:
Länkar:https://ncbi.nlm.nih.gov/pmc/articles/PMC8117783/
https://ncbi.nlm.nih.gov/pubmed/33939913
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.1c00140
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