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

Table 2. Lipid Order Parameters for the DOPC/DPPC Membrane Systems for the CHARMM36 AA and Martini 3.0 Models across the Simulated Temperatures.

DOPC/DPPC
temperature (K) AA Martini 3.0
Membrane Thickness (nm)
290 4.07 3.97
305 3.95 3.90
320 3.90 3.84
335 3.85 3.79
P2
290 0.54/0.67 0.49/0.57
305 0.52/0.61 0.46/0.53
320 0.50/0.57 0.45/0.50
335 0.49/0.55 0.42/0.48
6|
290 0.38/0.43 0.37/0.38
305 0.37/0.39 0.36/0.37
320 0.37/0.38 036/0.37
335 0.37/0.37 0.36/0.36