Published January 14, 2015
| Version v1
Dataset
Open
MD simulation trajectory and related files for POPC bilayer in medium low hydration (CHARMM36, Gromacs 4.5)
Creators
- 1. Aalto University
- 2. Freie Universität Berlin, Germany
Description
Equilibrated POPC lipid bilayer simulation ran with Gromacs 4.5, CHARMM36 force field in medium low hydration (dx.doi.org/10.1021/jp101759q), 20ns, T=303K, 72 POPC molecules, 1080 water molecules. This data is ran for the nmrlipids.blospot.fi project. More details from nmrlipids.blospot.fi and https://github.com/NMRLipids/nmrlipids.blogspot.fi. If data is used, please cite nmrlipids.blogspot.fi project and the original publication of the parameters (dx.doi.org/10.1021/jp101759q).
Files
Files
(2.5 GB)
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md5:0b3c35b12f3592cc2a63e32fac495258
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md5:0bfa9ed73f570772aa7493e7e60380bc
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md5:1cf8dec19ce32195535c3c4db88454c8
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1.2 GB | Download |
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md5:98a6b1da4239337708c059698a469cb9
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1.2 GB | Download |
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md5:34ef53c57c12aa96797f0ce789275dbd
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465.7 kB | Download |
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md5:0180822362b92db989a3ea859e95ccf2
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889.3 kB | Download |
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md5:cbceea6e1b7c6e574f3a3d186fde2af0
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183 Bytes | Download |