Modeling membranes in situ
Review
Lipid membranes
Multi-scale
Proteins
Citation (APA 7)
Brown, C. M., & Marrink, S. J. (2024). Modeling membranes in situ. Current Opinion in Structural Biology, 87, 102837.
Abstract
Molecular dynamics simulations of cellular membranes have come a long way—from simple model lipid bilayers to multicomponent systems capturing the crowded and complex nature of real cell membranes. In this opinionated minireview, we discuss the current challenge to simulate the dynamics of membranes in their native environment, in situ, with the prospect of reaching the level of whole cells and cell organelles using an integrative modeling framework.