integrator = md dt = 0.002 nsteps = 50000000 nstlog = 1000 nstxtcout = 50000 nstcalcenergy = 100 nstenergy = 1000 cutoff-scheme = Verlet nstlist = 20 rlist = 1.2 coulombtype = pme rcoulomb = 1.2 vdwtype = Cut-off vdw-modifier = Force-switch rvdw_switch = 1.0 rvdw = 1.2 tcoupl = Nose-Hoover tc_grps = MEMBRANE SOLVENT tau_t = 1.0 1.0 ref_t = 310.15 310.15 pcoupl = Parrinello-Rahman pcoupltype = semiisotropic tau_p = 5.0 5.0 compressibility = 4.5e-5 4.5e-5 ref_p = 1.0 1.0 constraints = h-bonds constraint_algorithm = LINCS continuation = yes nstcomm = 100 comm_mode = linear comm_grps = MEMBRANE SOLVENT refcoord_scaling = com