Article
Singular Interface Dynamics of the SARS-CoV-2 Delta Variant Explained with Contact Perturbation Analysis.
Journal of chemical information and modeling - 27 Jun 2022
Gheeraert Aria, Vuillon Laurent, Chaloin Laurent, Moncorgé Olivier, Very Thibaut, Perez Serge, Leroux Vincent, Chauvot de Beauchêne Isaure, Mias-Lucquin Dominique, Devignes Marie-Dominique, Rivalta Ivan, Maigret Bernard
Abstract excerpt
Emerging SARS-CoV-2 variants raise concerns about our ability to withstand the Covid-19 pandemic, and therefore, understanding mechanistic differences of those variants is crucial. In this study, we investigate disparities between the SARS-CoV-2 wild type and five variants that emerged in late 2020, focusing on the structure and dynamics of the spike protein interface with the human angiotensin-converting enzyme...
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