MD simulation of POPC bilayer with OPLS3e force field, 200 mM NaCl part 2

MD simulation of POPC bilayer with OPLS3e force field, 200 mM NaCl part 2 (500-1000ns)

Dataset contains trajectories (_trj) for the last 500ns of the 1000ns trajectory and topology (-out.cms).

For the ease of the upload, trajectory files (_trj) are divided to 100ns pieces and tarred (named desmond_md_nacl200_x-xns.tar.gz)

Dataset also contains Gromacs converted trajectory (.xtc) for the last 500 ns of 1000 ns trajectory

System: POPC bilayer in water

Number of lipids: 200 (100/leaflet)

Number of waters: 8880

Concentration: 200 mM

Number of cations: 32

Simulation time: 1000 ns (in this dataset 500-1000ns)

Simulation engine: Desmond 2019-4

Temperature: 300 K

Related dataset: MD simulation of POPC bilayer with OPLS3e force field, 200 mM NaCl part 1