Published September 12, 2023
| Version v1
Dataset
Open
All-atom MD simulations of POPC/SSM/CHOL mixture
Authors/Creators
- 1. Technische Universität Dortmund
- 2. INSERM
Description
All-atom MD simulation of lipid bilayer in water, with composition POPC/SSM/CHOL, at 321.15 K, NPT conditions.
Force field: CHARMM36. Water model: TIP3P. Number of molecules: 100 POPC + 100 SSM + 100 CHOL + 9000 SOL + 18 Na+ + 18 Cl-.
SSM is (d18:1/18:0) sphingomyelin.
Duration of the simulation: 300 ns.
Files
Files
(787.0 MB)
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