遇见数据集

MD simulation of POPC bilayer with CHARMM36 force field, 1000 mM NaCl

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Zenodo2022-05-25 更新2026-05-25 收录
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MD simulation of POPC bilayer with CHARMM36 force field, 1000 mM NaCl Dataset contains simulation files including centered and equilibrated trajectory Nacl1000mM-15-500ns.xtc. System: POPC bilayer in water Number of lipids: 200 (100/leaflet) Number of waters: 8880 Salt: NaCl Concentration: 1000 mM Number of cations: 160 Simulation time: 500 ns Simulation engine: GROMACS 2019.5 Temperature: 300 K

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Zenodo
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2022-05-25
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