TY  - CHART
AU  - Chen, Shu-Yu
AU  - Feilen, Lukas Peter
AU  - Chávez-Gutiérrez, Lucía
AU  - Steiner, Harald
AU  - Zacharias, Martin
TI  - Dataset: Enzyme-substrate hybrid β-sheet controls geometry and water access to the γ-secretase active site, v1
PB  - Zenodo
M1  - DZNE-2025-00203
PY  - 2023
AB  - Raw data, initial PDB files, and Python codes used to generate the figures in the work ' Enzyme-substrate hybrid β-sheet controls geometry and water access to the γ-secretase active site ' in Communication Biology. To generate the figures, unzip data.zip and launch Jupyter notebook/lab in the directory './data/analysis' and run all codes in notebooks 'Plot_restraint-free.ipynb' and 'Plot_PMF.ipynb' . Python dependency: python 3.x numpy matplotlib pandas seaborn scipy
LB  - PUB:(DE-HGF)32
DO  - DOI:10.5281/zenodo.7953842
UR  - https://pub.dzne.de/record/276122
ER  -