GROMOS 43A1-S3 POPE Simulations (versions 1 and 2) 313 K (NOTE: anisotropic pressure coupling)

<p>Two&nbsp;GROMOS 43A1-S3 POPE bilayer simulations performed using GROMACS 4.0.7 for 200 ns&nbsp;with different starting velocities. Simulations were performed with the standard 43A1-S3 settings: a 1.0&nbsp;nm cut-off with PME for the Coulombic interactions and a twin-range 1.0/1.6 nm cut-off for the van der Waals interactions. These simulations were performed at 313 K with a 128 lipid bilayer and used anisotropic pressure coupling. The full trajectories are provided bar&nbsp;the initial 100 ns. The starting structure was made through&nbsp;the conversion of an equilibrated GROMOS 43A1-S3 POPC membrane.</p>