Continuous Integration #1343
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name: Continuous Integration | |
# adapted from openff-evaluator/.github/workflows/continuous_integration.yaml | |
on: | |
push: | |
branches: | |
- master | |
pull_request: | |
branches: | |
- master | |
schedule: | |
- cron: '0 0 * * *' | |
jobs: | |
test: | |
runs-on: ubuntu-latest | |
strategy: | |
fail-fast: false | |
matrix: | |
python-version: ["3.7", "3.8"] | |
environ: [base, adapter_parsl, adapter_dask, adapter_fireworks, openff, dev_head] | |
exclude: | |
- python-version: "3.7" | |
environ: dev_head | |
- python-version: "3.8" | |
environ: dev_head | |
- python-version: "3.8" | |
environ: openff | |
- python-version: "3.8" | |
environ: adapter_parsl | |
steps: | |
- uses: actions/checkout@v2 | |
- name: Additional info about the build | |
run: | | |
uname -a | |
df -h | |
ulimit -a | |
- name: Configure conda | |
uses: conda-incubator/setup-miniconda@v2.1.1 | |
with: | |
python-version: ${{ matrix.python-version }} | |
activate-environment: qcarchive | |
environment-file: devtools/conda-envs/${{ matrix.environ }}.yaml | |
auto-activate-base: false | |
auto-update-conda: true | |
show-channel-urls: true | |
mamba-version: "*" | |
miniforge-version: latest | |
miniforge-variant: Mambaforge | |
use-mamba: true | |
- name: Environment Information | |
shell: bash -l {0} | |
run: | | |
conda info | |
conda list | |
- name: Start MongoDB | |
if: ${{ matrix.environ == 'adapter_fireworks' }} | |
uses: supercharge/mongodb-github-action@1.3.0 | |
- name: Install package | |
shell: bash -l {0} | |
run: | | |
python setup.py develop --no-deps | |
- name: Key component versions | |
shell: bash -l {0} | |
run: | | |
mongod --version | |
psql --version | |
- name: Run tests | |
shell: bash -l {0} | |
run: | | |
pytest -v -rsx --runslow --cov=qcfractal qcfractal/ --tb=short --cov-report=xml | |
# TODO: verify this works as we expect | |
- name: Code coverage | |
uses: codecov/codecov-action@v2 | |
with: | |
file: ./coverage.xml | |
fail_ci_if_error: true |