Published September 13, 2022
| Version v1
Dataset
Open
Scaling protein-water interactions in the Martini 3 coarse-grained force field to simulate transmembrane helix dimers in different lipid environments
Authors/Creators
- 1. Heidelbrg Institute of Theoretical Studies (HITS), Heidelberg University
- 2. Heidelberg Institute for Theoretical Studies (HITS), Center for Molecular Biology (ZMBH), DKFZ-ZMBH Alliance, Heidelberg University
Description
This dataset contains molecular dynamics (MD) trajectories used for preparation of the following manuscript:
"Scaling protein-water interactions in the Martini 3 coarse-grained force field to simulate transmembrane helix dimers in different lipid environments".
Notes
The authors acknowledge support by the state of Baden-Württemberg through bwHPC and the German Research Foundation (DFG) through grant INST 35/1134-1 FUGG and the Klaus Tschira Foundation.
Files
GpA.zip
Files
(46.4 GB)
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