Published December 9, 2015
| Version v1
Dataset
Open
POPC_AMBER_LIPID14_CaCl2_1Mol
Description
MD simulation trajectory and related files for fully hydrated POPC bilayer with 1M CaCl2. The LIPID14 force field was used with Gromacs 5.0.3. Ions were described by AMBER99SB-ILDN force field. Conditions: T=298.15, 128 POPC molecules, 6400 tip3p waters (lipid/water 1:50), 100 Ca, 200 Cl. 200ns trajectory (preceded by 5ns NPT equillibration) (2 files of 100ns).
Files
Files
(2.9 GB)
| Name | Size | |
|---|---|---|
|
md5:ec981dd44f02782817a410663c7754ee
|
1.2 MB | Download |
|
md5:bcf37a3a0c2971405ae511a10f8b2603
|
1.4 GB | Download |
|
md5:8f5160e2cf113c4183b97bbbf83ffc8a
|
1.4 GB | Download |
|
md5:37edf369e2a7a0573e06ff17c2244fe3
|
2.5 MB | Download |
|
md5:b81d80de7ed0a38906047719d27d630a
|
64.8 MB | Download |
|
md5:3099c3d85cdf89192ed2cd27b53af754
|
69.7 MB | Download |
|
md5:f5c9b1a57bd075d6e3b2f6e11ec993d1
|
11.6 kB | Download |
|
md5:97b55eaea2fce0fa9dc2d0a5fa08c3ae
|
100.2 kB | Download |
|
md5:655dfcc23cc4d4819526829d46d2e5d9
|
1.3 kB | Download |
|
md5:fa9515677e60b7045dbe1caba5f6e997
|
2.5 MB | Download |
|
md5:95e6b6bbe05d903eb8fa3b25b63e012e
|
494 Bytes | Download |