遇见数据集

MD simulation of POPC bilayer with CHARMM36 force field, 200 mM NaCl

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Zenodo2022-03-09 更新2026-04-07 收录
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MD simulation of POPC bilayer with CHARMM36 force field, 200 mM NaCl Dataset contains simulation files including centered and equilibrated trajectory Nacl200mM-45-500ns.xtc. System: POPC bilayer in water Number of lipids: 200 (100/leaflet) Number of waters: 8880 Salt: NaCl Concentration: 200 mM Number of cations: 32 Simulation time: 500 ns Simulation engine: GROMACS 2019.5 Temperature: 300 K

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2022-03-09
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