Update OCP-introduction.ipynb to use checkpoint_path parameter in OCP… #52
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| name: deploy | |
| on: | |
| # Trigger the workflow on push to main branch | |
| push: | |
| branches: | |
| - main | |
| # This job installs dependencies, build the book, and pushes it to `gh-pages` | |
| jobs: | |
| build-and-deploy-book: | |
| defaults: | |
| run: | |
| shell: bash -l {0} | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| matrix: | |
| os: [ubuntu-latest] | |
| python-version: [3.9] | |
| steps: | |
| - uses: actions/checkout@v2 | |
| # Install dependencies | |
| - name: Set up Python ${{ matrix.python-version }} | |
| uses: actions/setup-python@v1 | |
| with: | |
| python-version: ${{ matrix.python-version }} | |
| - name: Install dependencies | |
| run: | | |
| pip install -r requirements.txt | |
| wget https://repo.anaconda.com/miniconda/Miniconda3-py39_22.11.1-1-Linux-x86_64.sh -O miniconda.sh | |
| bash miniconda.sh -b -p "$HOME"/miniconda | |
| source "$HOME"/miniconda/etc/profile.d/conda.sh | |
| conda activate base | |
| # Conda configuration | |
| conda config --set always_yes yes --set auto_update_conda false | |
| # Update conda | |
| conda update conda | |
| conda install mamba -n base -c conda-forge | |
| # Install ocp conda env | |
| source "$HOME"/miniconda/etc/profile.d/conda.sh | |
| conda install -c conda-forge conda-merge | |
| git clone https://github.com/Open-Catalyst-Project/ocp.git | |
| cd ocp && conda-merge env.common.yml env.cpu.yml > env.yml && mamba env update -n base --file env.yml | |
| pip install -e . | |
| python -c "import ocpmodels as om; print(om.__file__)" | |
| python -c "import ocpmodels.common.relaxation.ase_utils as au; print(au.__file__)" | |
| cd "$HOME" | |
| # Build the book | |
| - name: Build the book | |
| run: | | |
| jupyter-book build ocp-tutorial | |
| # Deploy the book's HTML to gh-pages branch | |
| - name: GitHub Pages action | |
| uses: peaceiris/[email protected] | |
| with: | |
| github_token: ${{ secrets.GITHUB_TOKEN }} | |
| publish_dir: ocp-tutorial/_build/html |