Links

Tools

Export citation

Search in Google Scholar

Centered trajectories of NMRlipids II

Dataset published in 2016 by Markus S. Miettinen ORCID
This paper is available in a repository.
This paper is available in a repository.

Full text: Download

Question mark in circle
Preprint: policy unknown
Question mark in circle
Postprint: policy unknown
Question mark in circle
Published version: policy unknown

Abstract

Collection of molecular dynamics simulation trajectories previously published in the NMRlipids community of Zenodo, and the related input files needed for their analysis. These centered (origin at the lipid bilayer center) trajectories were used in the NMRlipids II project. In addition to trajectories, files containing lipidwise C-H order parameters (for the beta and alpha segments of the PC-lipid headgroup) for each frame are provided. Note that this upload is provided just for the ease of repetition of the analysis by the interested reader of the NMRlipids II publication Molecular electrometer and binding of cations to phospholipid bilayers (http://dx.doi.org/10.1039/c6cp04883h). If you use any data provided in here for your own work, please cite the corresponding original uploads!