General clean-up, especially around docs, in preparation for v1.0 #806
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name: Check Colab Notebook | |
on: | |
schedule: | |
# run at 10am on every Monday | |
- cron: '0 10 * * 1' | |
pull_request: | |
# Check all PR | |
jobs: | |
pull-notebook: | |
runs-on: ubuntu-latest | |
steps: | |
# Pulls the Notebook from the Google Collab URL | |
- name: wget-notebook | |
uses: wei/wget@v1 | |
with: | |
args: -O downloaded_file.ipynb 'https://docs.google.com/uc?export=download&id=1NU0gjtaHcB5Oc3NbFZiQYtctY2190hDu' | |
# Pulls an example dataset from rascaline's repository | |
- name: wget-dataset | |
uses: wei/wget@v1 | |
with: | |
args: -O frames.xyz 'https://raw.githubusercontent.com/Luthaf/rascaline/a7af348694d5268b05a89c4773b3f51211e3b344/docs/static/dataset.xyz' | |
- name: install Python | |
uses: actions/setup-python@v4 | |
with: | |
python-version: '3.9' | |
- name: install dependencies | |
run: | | |
pip install wheel numpy tqdm jupyter nbconvert | |
pip install ase chemiscope scikit-learn skmatter | |
pip install git+https://github.com/lab-cosmo/librascal | |
# Checks that the notebook can run without errors | |
- name: run notebook | |
run: | | |
jupyter nbconvert --to notebook --execute downloaded_file.ipynb |