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. Author manuscript; available in PMC: 2017 Sep 12.
Published in final edited form as: J Chem Theory Comput. 2017 Aug 8;13(9):4535–4552. doi: 10.1021/acs.jctc.7b00262

Table 1.

Bilayer systems modeled in this study. All bilayer system comprise 72 lipid molecules, with equal number in the upper and lower leaflet (DPPC† is a larger system comprising 288 lipid molecules).

System Temperature (K) Hydration Ratio (Nwater/Nlipid)
DPPC 323 30.4
DPPC 323 30.4
DMPC 303 25.7
DLPC 303 31.3
POPC 293, 303, 323, 333 31.1
DOPC 293, 303, 323, 333 33.5
DPPE 342 32.0
POPE 303 32.0
DOPE 298 32.0