Water-Glycan Interactions Drive the SARS-CoV-2 Spike Dynamics: Insights into Glycan-Gate Control and Camouflage Mechanism
M. Blazhynska, L. Lagardere, C. Liu, O. Adjoua, P. Ren, J.-P. Piquemal
The paper uses molecular dynamics simulations to analyze water-glycan interactions in SARS-CoV-2 spike protein states, revealing structural and dynamic differences that impact immune evasion.
Chemical Science · Jan 1, 2024Peer-reviewedBiophysics