TST: remove unnecessary commands from test workflow #8
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name: Tests | |
on: | |
push: | |
branches: [master] | |
pull_request: | |
jobs: | |
build-linux: | |
runs-on: ubuntu-latest | |
strategy: | |
max-parallel: 5 | |
steps: | |
- uses: actions/checkout@v4 | |
- name: Set up Python 3.11 | |
uses: actions/setup-python@v3 | |
with: | |
python-version: '3.11' | |
- name: Add conda to system path | |
run: | | |
# $CONDA is an environment variable pointing to the root of the miniconda directory | |
echo $CONDA/bin >> $GITHUB_PATH | |
- name: Install conda dependencies | |
run: | | |
conda env update --file environment.yml --name base | |
- name: Install pip dependencies | |
run: | | |
pip install -e '.[dev]' | |
- name: Append LAMMPS paths | |
run: | | |
echo "LAMMPS_POTENTIALS=$GITHUB_WORKSPACE/mcmc/potentials" >> $GITHUB_ENV | |
echo "LAMMPS_COMMAND=$CONDA/bin/lmp" >> $GITHUB_ENV | |
echo "ASE_LAMMPSRUN_COMMAND=$CONDA/bin/lmp" >> $GITHUB_ENV | |
- name: Check LAMMPS paths | |
run: | | |
echo "LAMMPS_POTENTIALS = $LAMMPS_POTENTIALS" | |
echo "LAMMPS_COMMAND = $LAMMPS_COMMAND" | |
echo "ASE_LAMMPSRUN_COMMAND = $ASE_LAMMPSRUN_COMMAND" | |
- name: Test with pytest | |
run: | | |
pytest --capture=no --cov --cov-report=xml |