遇见数据集

1-palmitoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine (PDPC) lipid bilayer , 303K, CHARMM36m-WYF forcefield, NAMD 3.0.2, 2* 500 ns

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Zenodo2026-02-25 更新2026-05-26 收录
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1-palmitoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine (PDPC) lipid bilayer. 200 lipid molecules (100 lipids per leaflet) and no ions. Lipid for a total water content of 50 wt% >>> Hydration: 45 Temperature: 303.15 System was prepared using CHARMM-GUI. CHARMM36m-WYF forcefield was used. Simulation was performed with NAMD 3.0.2. timestep: 2.0 fs 500 ns production after 150 ns equilibration dcd saving freq: 10000 2 replicates

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2026-02-25
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