Table 1 Composition of the model membranes simulated.

From: Insight from Molecular dynamic simulation of reactive oxygen species in oxidized skin membrane

Oxidized Skin-lipid Bilayer System

Composition

CER

CHO

FFA

5α-CH

MEMB_12.5

(12.5 mol % of 5α-ChOOH)

52

44

52

6

MEMB_50

(50 mol % of 5α-ChOOH)

52

25

52

25

  1. The total number of lipid molecules was 154 in each bilayer system with 77 in one of the leaflet and 77 in the other.