Article
The transmembrane domain of Neu in a lipid bilayer: molecular dynamics simulations.
European biophysics journal : EBJ - 1 Nov 2004
van der Ende Bryan M, Sharom Frances J, Davis James H
Abstract excerpt
The results of full-atom molecular dynamics simulations of the transmembrane domains (TMDs) of both native, and Glu664-mutant (either protonated or unprotonated) Neu in an explicit fully hydrated dimyristoylphosphatidylcholine (DMPC) lipid bilayer are presented. For the native TMD peptide, a 10.05 ns trajectory was collected, while for the mutant TMD peptides 5.05 ns trajectories were collected for each. The...
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