lammps-user-backmapping/.github/workflows/python-ci.yml at main · jkrajniak/lammps-user-backmapping · GitHub

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name: Python CI

on:
  push:
    branches: [main]
    paths:
      - "python/**"
      - "pyproject.toml"
      - "uv.lock"
      - ".github/workflows/python-ci.yml"
  pull_request:
    branches: [main]
    paths:
      - "python/**"
      - "pyproject.toml"
      - "uv.lock"
      - ".github/workflows/python-ci.yml"

concurrency:
  group: python-ci-${{ github.ref }}
  cancel-in-progress: true

jobs:
  lint:
    name: Lint & Format
    runs-on: ubuntu-latest
    steps:
      - uses: actions/checkout@v4

      - name: Install uv
        uses: astral-sh/setup-uv@v5

      - name: Set up Python
        run: uv python install 3.13

      - name: Install dependencies
        run: uv sync --extra dev

      - name: Ruff lint
        run: uv run ruff check python/src/ python/tests/

      - name: Ruff format check
        run: uv run ruff format --check python/src/ python/tests/

  typecheck:
    name: Type Check
    runs-on: ubuntu-latest
    steps:
      - uses: actions/checkout@v4

      - name: Install uv
        uses: astral-sh/setup-uv@v5

      - name: Set up Python
        run: uv python install 3.13

      - name: Install dependencies
        run: uv sync --extra dev

      - name: mypy
        run: uv run mypy python/src/

  test:
    name: Tests (Python ${{ matrix.python-version }})
    runs-on: ubuntu-latest
    strategy:
      fail-fast: false
      matrix:
        python-version: ["3.10", "3.12", "3.13"]
    steps:
      - uses: actions/checkout@v4

      - name: Install uv
        uses: astral-sh/setup-uv@v5

      - name: Set up Python ${{ matrix.python-version }}
        run: uv python install ${{ matrix.python-version }}

      - name: Install dependencies
        run: uv sync --extra dev

      - name: Run tests
        run: uv run pytest --cov=backmap_prep --cov-report=term-missing