Published August 24, 2020
| Version v1
Dataset
Open
POPC:POPG 1:1 MD simulation with CHARMM36 in water and Na+ counter ions
Authors/Creators
Description
CHARMM36 POPC:POPG 1:1 bilayer simulation in water. The initial structure was taken from CHARMM-GUI. Temperature is 298 K. The system contains 150 POPC, 150 POPG, 150 sodium ions and 31500 TIP3 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
(7.4 GB)
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md5:e889197d0745c71df3f230109e40530c
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7.4 GB | Download |
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md5:12d96c976c4afd9cf0ef0045e2009d3a
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6.0 MB | Download |
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md5:6cf61a05300fb1b30fa3b1a995b5ff92
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29.0 kB | Download |
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md5:5f692ad4591c0fb3ba6f3b23a620e079
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38.6 kB | Download |
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md5:8e8b926d258b8ea28d761469d4e366ba
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36.5 kB | Download |
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md5:5fe43e9d45a6ee20e81a9121fcb47920
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3.3 MB | Download |
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md5:c79f8f9fcaa76847164bf606d2672c6d
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334 Bytes | Download |
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md5:1c2bd47c32a1f585a2c3467df19a2f69
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1.2 kB | Download |
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md5:e163a90c2d069565f80d1c2b4857d4ce
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648 Bytes | Download |
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md5:4d86c43c9874c9175735f7b79379a768
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457 Bytes | Download |