A multiscale methodologyinvestigates the effect of membrane proteins on lipid structure and dynamics incell membranes. The proposed strategy explores both the formation of generalised lipid microdomains andthe communicationbetween membrane proteins mediated by these lipid microdomains. Atomically detailedmolecular dynamics (MD) simulations model protein-lipid interactions and quantify the local order of theboundary lipids within the immediate solvation shell of the protein. A coarse-grained model examines thelong-time dynamicsof these boundary lipids and their exchange with lipids outside of the protein solvationshell. A time-dependent field theory couples the local perturbation induced by the protein and this exchangeprocess is coupled with mesoscopic membrane dynamics and the emergent development of long rangecorrelations in the lipid structure.
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