Add patchy pair potential #497
Workflow file for this run
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| name: Test | |
| concurrency: | |
| group: ${{ github.workflow }}-${{ github.ref }} | |
| cancel-in-progress: true | |
| on: | |
| pull_request: | |
| types: [opened, labeled, reopened, synchronize] | |
| push: | |
| branches: | |
| - "trunk-*" | |
| workflow_dispatch: | |
| jobs: | |
| start_action_runners: | |
| name: Start | |
| uses: glotzerlab/jetstream2-admin/.github/workflows/start.yaml@98f840ba341f72bf412100f2180d38c06e792b84 # v1.3.1 | |
| secrets: inherit | |
| typical: | |
| name: "${{ join(matrix.config, '') }}" | |
| needs: start_action_runners | |
| uses: ./.github/workflows/build_and_test.yaml | |
| with: | |
| compiler_family: ${{ matrix.config[0] }} | |
| compiler_version: ${{ matrix.config[1] }} | |
| python: ${{ matrix.config[3] }} | |
| config: ${{ join(matrix.config, '_') }} | |
| # Use self-hosted runners or fall back to GitHub hosted runners when self-hosted are offline. | |
| build_runner: ${{ needs.start_action_runners.outputs.active != '0' && '["self-hosted","jetstream2","CPU"]' || toJson('ubuntu-24.04') }} | |
| # Default to false when unset | |
| validate: ${{ matrix.validate && 'true' || 'false'}} | |
| release: false | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| include: | |
| - config: [clang, 18, -py, 312, -mpi, -tbb] | |
| validate: true | |
| - config: [gcc, 14, -py, 312] | |
| validate: true | |
| - config: [gcc, 14, -py, 312, -nomd] | |
| - config: [gcc, 14, -py, 312, -nohpmc] | |
| - config: [gcc, 14, -py, 312, -nomd, -nohpmc] | |
| - config: [gcc, 10, -py, 39, -mpi, -tbb] | |
| - config: [cuda, 125, -py, 312, -mpi] | |
| validate: true | |
| - config: [cuda, 125, -py, 312] | |
| validate: true | |
| - config: [cuda, 125, -py, 312, -mpi, -debug] | |
| release: | |
| if: ${{ contains(github.event.pull_request.labels.*.name, 'release') }} | |
| name: "${{ join(matrix.config, '') }}" | |
| needs: start_action_runners | |
| uses: ./.github/workflows/build_and_test.yaml | |
| with: | |
| compiler_family: ${{ matrix.config[0] }} | |
| compiler_version: ${{ matrix.config[1] }} | |
| python: ${{ matrix.config[3] }} | |
| config: ${{ join(matrix.config, '_') }} | |
| # Use self-hosted runners or fall back to GitHub hosted runners when self-hosted are offline. | |
| build_runner: ${{ needs.start_action_runners.outputs.active != '0' && '["self-hosted","jetstream2","CPU"]' || toJson('ubuntu-24.04') }} | |
| # Default to false when unset | |
| validate: ${{ matrix.validate && 'true' || 'false'}} | |
| release: true | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| include: | |
| - config: [clang, 17, -py, 312, -mpi, -tbb] | |
| - config: [clang, 16, -py, 312, -mpi, -tbb] | |
| - config: [clang, 15, -py, 311, -mpi, -tbb] | |
| - config: [clang, 14, -py, 310, -mpi, -tbb] | |
| - config: [clang, 13, -py, 39, -mpi, -tbb] | |
| - config: [gcc, 13, -py, 312, -mpi, -tbb] | |
| - config: [gcc, 12, -py, 311, -mpi, -tbb] | |
| - config: [gcc, 11, -py, 310, -mpi, -tbb] | |
| - config: [gcc, 10, -py, 310, -mpi, -tbb] | |
| check-links: | |
| name: "Check links" | |
| runs-on: ubuntu-latest | |
| steps: | |
| - name: Check out repo | |
| uses: actions/checkout@a5ac7e51b41094c92402da3b24376905380afc29 # v4.1.6 | |
| with: | |
| submodules: true | |
| - name: Set up Python | |
| uses: actions/setup-python@82c7e631bb3cdc910f68e0081d67478d79c6982d # v5.1.0 | |
| with: | |
| python-version: "3.12" | |
| - name: Setup uv | |
| uses: glotzerlab/workflows/setup-uv@5cfac9da9cb78e16ae97a9119b6fd13c1c2d6f5e # 0.1.0 | |
| - name: Install dependencies | |
| run: uv pip install -r sphinx-doc/requirements.txt --system | |
| - name: Install tools | |
| run: sudo apt-get install pandoc | |
| - name: Build Sphinx Docs | |
| run: sphinx-build -b html sphinx-doc doc_build | |
| - name: Link Checker | |
| id: lychee | |
| uses: lycheeverse/lychee-action@2b973e86fc7b1f6b36a93795fe2c9c6ae1118621 # v1.10.0 | |
| with: | |
| args: -n './**/*.md' './**/*.html' './**/*.rst' | |
| --timeout 60 | |
| fail: true | |
| tests_complete: | |
| name: Unit test | |
| if: always() | |
| needs: [typical] | |
| runs-on: ubuntu-24.04 | |
| steps: | |
| - run: jq --exit-status 'all(.result == "success")' <<< '${{ toJson(needs) }}' | |
| - name: Done | |
| run: exit 0 |