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. 2020 Feb 25;16(4):2550–2560. doi: 10.1021/acs.jctc.9b01194

Table 3. Properties of Lipid Bilayers Containing DLiPC Only, DLiPC/CHOL, or DPPC/DLiPC/CHOL Simulated with MARTINI 2.2P and MARTINI 2.3P.

  DLiPC
DLiPC/CHOL
DLiPC/CHOL
  v2.2P v2.3P v2.2P v2.3P v2.2P v2.3P
average APL (nm2) 0.784 ± 0.001 0.785 ± 0.001 0.806 ± 0.001 0.806 ± 0.001 0.743 ± 0.001 0.743 ± 0.001
average area compressibility (mN/m) 197 ± 5 205 ± 5 211 ± 19 231 ± 14 224 ± 27 240 ± 17
average tail order DLiPC 0.206 ± 0.001 0.201 ± 0.001 0.219 ± 0.002 0.215 ± 0.002 0.231 ± 0.002 0.226 ± 0.002
average tail order DPPC         0.574 ± 0.003 0.580 ± 0.003
average bilayer thickness (nm) 3.468 ± 0.001 3.453 ± 0.001 2.778 ± 0.003 2.791 ± 0.002 4.091 ± 0.003 4.086 ± 0.001
CHOL flip-flop rate (106 s–1)     59 ± 3 57 ± 3 9.0 ± 0.4 8.3 ± 0.3