OpenFF POPE (64:64)
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资源简介：
128 lipid bilayer (64:64) hydrated with 5120 TIP3P waters. Equilibrated for 100 ns and simulated for 200 ns at 300K Partial charges assigned with OpenFF AM1BCC Parameters generated by OpenFF Toolkit (Mobley et al., 2018) + Interchange. Forcefield line: 'openff-2.1.0.offxml' from OpenFF Sage /media/julianne/DATA/Lipids/OpenFFLipid/POPC/
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Zenodo创建时间：
2024-04-26
