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. 2021 Jun 30;120(15):3050–3069. doi: 10.1016/j.bpj.2021.06.013

Table 1.

Simulation conditions

Systema Gate modeled? Lipids [Na+] (mM) Restraints Temperature (K) Time step (fs)
NR yes mix 150 no 303 2
NR_1fs yes mix 150 no 303 1
NR_POPC yes POPC 150 no 303 1
NR_310K yes mix 150 no 310.15 1
NR_V219D yes mix 150 no 303 2
GR no mix 150 gate 310.15 2
GR_POPC no POPC 150 gate 310.15 2
GR_120mM no mix 120 gate 310.15 2
GR_V219D no mix 150 gate 310.15 2
a

NR stands for no restraints; GR stands for gate restraints.