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Tests against beta/RC builds #180

Tests against beta/RC builds

Tests against beta/RC builds #180

Workflow file for this run

name: Tests against beta/RC builds
on:
schedule:
- cron: "0 3 * * 0"
workflow_dispatch:
defaults:
run:
shell: bash -l {0}
jobs:
test:
name: Test beta/RC builds on ${{ matrix.python-version }}
runs-on: ${{ matrix.os }}
strategy:
fail-fast: false
matrix:
os:
- ubuntu-latest
- macos-12
python-version:
- "3.11"
env:
OE_LICENSE: ${{ github.workspace }}/oe_license.txt
PYTEST_ARGS: -r fE --tb=short -nauto
steps:
- uses: actions/checkout@v4
with:
fetch-depth: 2
- name: Install environment with ${{ env.JOBNAME }}
uses: mamba-org/setup-micromamba@v1
with:
environment-file: devtools/conda-envs/test_env.yaml
condarc: |
channels:
- conda-forge/label/openmm_rc
- conda-forge/label/mdtraj_rc
- conda-forge/label/openff-toolkit_rc
- conda-forge/label/openff-interchange_rc
- openeye/label/rc
- openeye
- conda-forge
create-args: >-
python=${{ matrix.python-version }}
# default - will pull down 2.0 which we don't want!
# micromamba-version: latest
# pin to latest 1.x release
micromamba-version: "1.5.10-0"
- name: Make oe_license.txt file from GH org secret "OE_LICENSE"
env:
OE_LICENSE_TEXT: ${{ secrets.OE_LICENSE }}
run: |
echo "${OE_LICENSE_TEXT}" > ${OE_LICENSE}
- name: Install package
run: |
micromamba remove --force openff-toolkit openff-toolkit-base
python -m pip install .
- name: Install test plugins
run: python -m pip install utilities/test_plugins
- name: Environment Information
run: micromamba info && micromamba list
- name: Check links
run: pytest -r fE --tb=short openff/toolkit/_tests/test_links.py
- name: Run mypy
run: mypy -p "openff.toolkit"
- name: Run unit tests
run: |
PYTEST_ARGS+=" --ignore=openff/toolkit/_tests/test_examples.py"
PYTEST_ARGS+=" --ignore=openff/toolkit/_tests/test_links.py"
PYTEST_ARGS+=" --runslow"
pytest $PYTEST_ARGS
- name: Run code snippets in docs
run: |
pytest -v --doctest-glob="docs/*.rst" --doctest-glob="docs/*.md" docs/