Published February 19, 2019
| Version v1
Journal article
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Gromos POPG Bilayer Simulation (Last 100 ns, 150 mM NaCl, 310 K )
Description
Simulation of a POPG bilayer of 500 lipids (250 per leaflet) is simulated for 500 ns using Gromacs v5.1.2 in water solution with Na+ counterions and 150 mM of NaCl. The GROMOS-CKP-POPG-Tom_Piggot-v1 model wiht GROMOS57a7 is employed for lipids and the SCP model for water.
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), and the energy output file (.edr) are provided.