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Elucidation of cryptic and allosteric pockets within the SARS-CoV-2 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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Veröffentlicht in:bioRxiv
Hauptverfasser: Sztain, Terra, Amaro, Rommie, McCammon, J. Andrew
Format: Artigo
Sprache:Inglês
Veröffentlicht: Cold Spring Harbor Laboratory 2020
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Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7386507/
https://ncbi.nlm.nih.gov/pubmed/32743587
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1101/2020.07.23.218784
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