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Bump easyscience from 1.1.0. to 1.1.1 and clean up project structure #25

Bump easyscience from 1.1.0. to 1.1.1 and clean up project structure

Bump easyscience from 1.1.0. to 1.1.1 and clean up project structure #25

# This workflow will for a variety of Python versions
# - install the code base
# - lint the code base
# - test the code base
# - upload the test coverage to codecov
#
# It will also
# - build the package
# - check the package
#
# For more information see: https://help.github.com/en/actions/language-and-framework-guides/using-python-with-github-actions#publishing-to-package-registries
name: Test code and build package
on: [push, pull_request]
# Allow only one concurrent workflow, skipping runs queued between the run in-progress and latest queued.
concurrency:
group: ${{ github.workflow }}-${{ github.event.pull_request.number || github.ref }}
cancel-in-progress: false
jobs:
# Job 1: Check code consistency
code-consistency:
runs-on: ubuntu-latest
steps:
- name: Checkout repository
uses: actions/checkout@v4
- name: Set up Python
uses: actions/setup-python@v5
with:
python-version: '3.12'
- name: Check validity of pyproject.toml
run: |
pip install 'validate-pyproject[all]'
validate-pyproject pyproject.toml
- name: Install Python linter and code formatter and run in the project root
run: |
pip install ruff
ruff check .
- name: Suggestion to fix linter issues
if: ${{ failure() }}
run: |
echo "In project root run 'ruff check . --fix' and commit changes to fix issues."
exit 1
# Job 2: Test code and upload coverage to Codecov
code-testing:
needs: code-consistency # previous job 'code-consistency' need to be finished first
# current job matrix. if modified, remember to UPDATE the strategy in the next job
strategy:
fail-fast: false
matrix:
python-version: ['3.9', '3.10', '3.11', '3.12']
os: [ubuntu-24.04, windows-2022, macos-12, macos-14]
runs-on: ${{ matrix.os }}
steps:
- name: Checkout repository
uses: actions/checkout@v4
- name: Set up Python ${{ matrix.python-version }}
uses: actions/setup-python@v5
with:
python-version: ${{ matrix.python-version }}
- name: Upgrade package installer for Python
run: python -m pip install --upgrade pip
- name: Install Python dependencies
run: pip install '.[dev]'
- name: Run tests and create coverage report
run: >
pytest tests/
-n auto
--color=yes
--cov=./
--cov-report=xml:coverage/coverage.xml
--junitxml=./coverage/junit.xml
- name: Upload test results to Codecov
if: ${{ !cancelled() }}
uses: codecov/test-results-action@v1
with:
files: ./coverage/junit.xml
fail_ci_if_error: true # optional (default = false)
name: Pytest results
token: ${{ secrets.CODECOV_TOKEN }}
- name: Upload coverage report to Codecov
uses: codecov/codecov-action@v4
with:
files: ./coverage/coverage.xml
env_vars: OS,PYTHON
fail_ci_if_error: true # optional (default = false)
name: Pytest coverage
token: ${{ secrets.CODECOV_TOKEN }}
env:
OS: ${{ matrix.os }}
PYTHON: ${{ matrix.python-version }}
- name: Create Python package # dist/*.whl
run: python -m build --wheel --outdir dist
- name: Upload zipped Python package for next job
uses: actions/upload-artifact@v4
with:
name: EasyCrystallography_py${{ matrix.python-version }}_${{ matrix.os }}_${{ runner.arch }}
path: |
dist/*.whl
tests/
if-no-files-found: "error"
compression-level: 0
# Job 3: Test the package
package-testing:
needs: code-testing # previous job 'code-testing' need to be finished first
strategy:
fail-fast: false
matrix:
python-version: ['3.9', '3.10', '3.11', '3.12']
os: [ubuntu-24.04, windows-2022, macos-12, macos-14]
runs-on: ${{ matrix.os }}
steps:
- name: Set up Python ${{ matrix.python-version }}
uses: actions/setup-python@v5
with:
python-version: ${{ matrix.python-version }}
- name: Upgrade package installer for Python
run: python -m pip install --upgrade pip
- name: Download zipped Python package from previous job
uses: actions/download-artifact@v4
with: # name or path are taken from the upload step of the previous job
name: EasyCrystallography_py${{ matrix.python-version }}_${{ matrix.os }}_${{ runner.arch }}
path: . # directory to extract downloaded zipped artifacts
- name: Install Python package from previous job
shell: bash
run: pip install dist/*.whl
- name: Run tests
run: |
pip install pytest pytest-xdist
pytest tests/ -n auto --color=yes