/fold3Dplot_jupyter

graphical viewer of the alphafold results in jupyter notebook

Primary LanguageJupyter Notebook

fold3Dplot_jupyter

Graphical viewer of the alphafold results in jupyter notebook.

This is a jupyter notebook that draws the same figure as ColabFold (https://colab.research.google.com/github/sokrypton/ColabFold/blob/main/AlphaFold2.ipynb) from the result of AlphaFold (https://github.com/deepmind/alphafold) run on the local machine.

Requirements

  • numpy
  • pickle
  • py3Dmol
  • matplotlib.pyplot
  • ipywidgets
  • alphafold (only for save graphs (coverage_lDDT.png and PAE.png))
  • jupyter-notebook

3D plot on jupyter notebook

put fold3Dplot.ipynb in the result directory of alphafold.

{mv,cp} fold3Dplot.ipynb alphafold_results_directory/

Start jupyter

jupyter-notebook

Open fold3Dplot.ipynb on jupyter and run. The display changes interactively when the parameters are changed.

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Save graphs

If you want to save the plddt and pae graphs,

python3 save_foldplot.py alphafold_results_directory

saved coverage_lDDT.png and PAE.png

These were created using the ColabFold code as a reference. I would like to thank the ColabFold.