Input data for Biohybrid solar fuel catalyst structures of native and core photosystem I-Pt nanoparticle complexes
Abstract
This contains reduced data from an upcoming manscript investigating Biohybrid solar fuel catalyst structures of native and core photosystem I-Pt nanoparticle complexes. The data is taken directly from the directory structure that contains both the simulation and analysis, with excluded trajectory files and velocity files to fit within the zenodo upload limit.The tar command used to generate the tarball PSInanoparticle.tar.gz containing the all-atom MD input: tar -h -zcvf PSInanoparticle.tar.gz --exclude="*core*" --exclude="*dcd" --exclude="*BAK" --exclude="*mp4" --exclude="*out" --exclude="*.old" --exclude="*ppm" --exclude="*restart*" --exclude="*vel" .
Fields of Study & Subjects
Photosynthetic Processes and Mechanisms
Advanced Photocatalysis Techniques
Metalloenzymes and iron-sulfur proteins
Publication details
- Journal / source
- Zenodo (CERN European Organization for Nuclear Research)
- Publication date
- 13 January 2026
- Document type
- Dataset