SARS-CoV-2 simulations go exascale to predict dramatic spike opening and cryptic pockets across the proteome.
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Nat Chem. 2021 Jul;13(7):651-659. doi: 10.1038/s41557-021-00707-0. Epub 2021 May 24.
Nat Chem. 2021.
PMID: 34031561
Free PMC article.