Transfer chain IDs to OpenMM topology. (#1310) #19
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| name: Tests | |
| on: | |
| push: | |
| branches: master | |
| pull_request: | |
| branches: master | |
| jobs: | |
| build: | |
| name: Build (${{ matrix.python-version }}, ${{ matrix.os }}) | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| matrix: | |
| os: ["ubuntu-latest"] | |
| python-version: ["3.8", "3.9"] | |
| steps: | |
| - name: Check out source code | |
| uses: actions/checkout@v2 | |
| with: | |
| fetch-depth: 0 | |
| - name: Setup Miniconda | |
| uses: conda-incubator/setup-miniconda@v2 | |
| with: | |
| auto-update-conda: false | |
| python-version: ${{ matrix.python-version }} | |
| environment-file: devtools/environment-dev.yaml | |
| activate-environment: parmed-dev | |
| channels: conda-forge,bioconda | |
| # mamba-version: "*" | |
| - name: Environment Information | |
| shell: bash -l {0} | |
| run: | | |
| conda info | |
| conda list | |
| - name: Install and test | |
| shell: bash -lex {0} | |
| run: | | |
| bash -ex devtools/ci/install.sh | |
| - name: Upload Coverage Results | |
| uses: codecov/codecov-action@v1 | |
| if: endsWith(github.ref, '/master') | |
| with: | |
| token: ${{ secrets.CODECOV_TOKEN }} | |
| directory: test/ | |
| fail_ci_if_error: true |