Published August 24, 2020
| Version v1
Dataset
Open
POPC:POPG 4:1 MD simulation with CHARMM36 in water with Na+ counter ions
Authors/Creators
Description
CHARMM36 POPC:POPG 4:1 bilayer simulation in water. The initial structure was taken from CHARMM-GUI. Temperature is 298 K. The system contains 350 POPC, 88 POPG, 88 sodium ions and 26280 TIP3P water molecules.
Total length of simulation is 400 ns. First 100 ns were discarded. Saving frequency of 100-300ns.xtc is 20 ps.
Files
Files
(7.6 GB)
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md5:529f484365c08281b25fd5cdb52d647f
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7.6 GB | Download |
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md5:4b3f2129f6d6f2886f416c34a1b3c9cb
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6.2 MB | Download |
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md5:9f54617e4e0bcebcb2fab1d8167b7b94
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29.0 kB | Download |
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md5:441ade57746cc3fd828e465b89f467b1
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38.6 kB | Download |
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md5:649775ba7714eae7a4c6529a27fd706e
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36.5 kB | Download |
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md5:73a332bfff9bb3aef370c5ddade70c5f
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1.2 kB | Download |
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md5:ed379d62f69e4ca4da9baca67a7bfb1f
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3.4 MB | Download |
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md5:e163a90c2d069565f80d1c2b4857d4ce
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648 Bytes | Download |
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md5:574e5da2679a1b5e4750c3c08d0dc4d9
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456 Bytes | Download |