MD simulation trajectory and related files for POPC bilayer (Lipid14, Gromacs 4.5)

MD simulation trajectory and related files for POPC bilayer (Lipid14, Gromacs 4.5)

Description

Equilibrated POPC lipid bilayer simulation ran with Gromacs 4.5, Lipid14 force field (http://dx.doi.org/10.1021/ct4010307), 50ns, T=303K, 72 POPC molecules, 2234 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.
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Year of publication

2014

Authors

Department of Neuroscience and Biomedical Engineering

Marius Retegan - Creator

Samuli Ollila - Creator

Max Planck Institute for Chemical Energy Conversion - Contributor

Zenodo - Publisher

Other information

Fields of science

Computer and information sciences

Open access

Open

License

Other