N.B.: If you use the following files in your work, please cite the primary source. (see Description field)
Lipid: | CHOL - Cholesterol |
Forcefield: | opls-aa Rog2016 |
Software: | Gromacs 4.5, 4.6, 5.0 |
Version: | Kulig2015 |
Files: | CHOL.gro, CHOL.itp |
Description: | Primary source: https://www.sciencedirect.com/science/article/pii/S2352340916301755?via%3Dihub |
References: |
Kulig2015
Chemistry and Physics of Lipids, 195.
Cis and trans unsaturated phosphatidylcholine bilayers: A molecular dynamics simulation study Kulig2015b Data in Brief, 5. Topologies, structures and parameter files for lipid simulations in GROMACS with the OPLS-aa force field: DPPC, POPC, DOPC, PEPC, and cholesterol |