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. 2024 Oct 3;20(20):9190–9208. doi: 10.1021/acs.jctc.4c00868

Table 1. Lipid Order Parameters for the DOPC/DOPS Membrane Systems for the CHARMM36 AA and Martini 3.0 Models across the Simulated Temperatures.

DOPC/DOPS
temperature (K) AA Martini 3.0
Membrane Thickness (nm)
290 3.96 3.84
305 3.93 3.81
320 3.89 3.77
335 3.86 3.73
P2
290 0.55/0.54 0.51/0.52
305 0.54/0.53 0.49/0.50
320 0.53/0.51 0.47/0.48
335 0.52/0.50 0.45/0.45
6|
290 0.38/0.37 0.37/0.37
305 0.37/0.37 0.36/0.36
320 0.37/0.37 0.36/0.36
335 0.37/0.37 0.36/0.36