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MD simulation of POPC bilayer with OPLS4 force field. 5 w/l

<p>MD simulation of POPC bilayer with OPLS4 force field. 5w/l</p> <p>Dataset contains trajectories (_trj), topologies (-out.cms), input files and converted gromacs format files</p> <p>For the ease of the upload, trajectory file (_trj) is divided into 4 pieces and tarred (named <span>desmond_md_popc</span>_5wl_opls4_x-xns.tar.gz)</p> <p>System:&nbsp;POPC bilayer&nbsp;in water</p> <p>Number of lipids: 200 (100/leaflet)</p> <p>Number of waters: 1000</p> <p>Simulation time: 1000 ns</p> <p>Simulation engine: Desmond 2022-2</p> <p>&nbsp;</p> <p>Temperature: 300 K</p>

ShareScore

24/100

Overall dataset sharing score

Score breakdown

These five areas show where the dataset supports — or may limit — practical reuse.

Stewardship
4
Harmonization
4
Access
16
Reuse readiness
0
Engagement
0