CHARMM36 POPG-POPE 3:1 Bilayer Simulation (Last 100 ns, 310 K )

Simulation of a POPG-POPE 3:1 bilayer of 500 lipids (374 L-POPG lipids and 126 POPE lipids, 250 per leaflet) is simulated for 500 ns using Gromacs v2018.3 in water solution with Na+ counterions. The CHARMM36 model is employed for lipids with CHARMM36 TIP3P Water Model.

Trajectory (.xtc) is for the last 100 ns of a simulation of 500 ns with data saved every 10 ps. Additionally, the topology (.top) , simulation parameter file (.mdp), index file (.ndx),  portable binary run input file (.tpr) and the energy output file (.edr) are provided.