Mechanism of Mycolactone Toxin Membrane Permeation: Atomistic vs Coarse-Grained MARTINI Simulations
F. Aydin, R. Sun, J. M. J. Swanson
This study compares atomistic and coarse-grained simulations of mycolactone isomers interacting with DPPC membranes to understand their permeation mechanisms.
bioRxiv · Nov 14, 2018Biophysics