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Published in 2022 at "International Journal of Molecular Sciences"
DOI: 10.3390/ijms23084376
Abstract: In this study, we combine all-atom MD simulations and comprehensive mutational scanning of S-RBD complexes with the angiotensin-converting enzyme 2 (ACE2) host receptor in the native form as well as the S-RBD Delta and Omicron…
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Keywords:
network;
allosteric interactions;
omicron mutations;
host receptor ... See more keywords