Fix initial pos mol (#34) #114
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| name: run tests | |
| on: | |
| push: | |
| pull_request: | |
| permissions: | |
| contents: read # to fetch code (actions/checkout) | |
| jobs: | |
| ubuntu: | |
| runs-on: ubuntu-latest | |
| steps: | |
| - name: Setup EESSI | |
| uses: eessi/github-action-eessi@v3 | |
| with: | |
| eessi_stack_version: "2023.06" | |
| - name: Checkout repository | |
| uses: actions/checkout@main | |
| - name: Install dependencies | |
| run: | | |
| module load ESPResSo/4.2.1-foss-2023a | |
| python3 -m venv --system-site-packages pymbe | |
| source pymbe/bin/activate | |
| python3 maintainer/configure_venv.py | |
| python3 -m pip install -r requirements.txt | |
| python3 -m pip install "pdoc==14.3" | |
| deactivate | |
| - name: Run testsuite | |
| run: | | |
| module load ESPResSo/4.2.1-foss-2023a | |
| source pymbe/bin/activate | |
| make tests | |
| make docs | |
| deactivate | |
| shell: bash | |
| - name: Upload artifact | |
| uses: actions/upload-artifact@v4 | |
| with: | |
| path: "./documentation" | |
| name: documentation | |
| retention-days: 2 | |
| if-no-files-found: error |