Test Python package #552

	name: Test Python package

	on:
	push:
	branches:
	- master
	pull_request:
	merge_group:

	env:
	UV_SYSTEM_PYTHON: 1
	jobs:
	build:
	runs-on: ubuntu-latest
	permissions:
	id-token: write
	contents: read
	steps:
	- uses: actions/checkout@v7
	- name: Set up uv
	uses: astral-sh/setup-uv@v7
	with:
	enable-cache: true
	cache-dependency-glob: \|
	*/requirements.txt
	**/pyproject.toml
	- name: Set up Python
	uses: actions/setup-python@v6
	with:
	python-version: 3.12
	- name: Install dependencies
	run: uv pip install nox[uv]
	- name: Test with pytest
	run: nox -db uv -s tests
	- name: Upload coverage reports to Codecov
	uses: codecov/codecov-action@v7
	with:
	use_oidc: ${{ !(github.event_name == 'pull_request' && github.event.pull_request.head.repo.fork) }}
	lammps:
	name: Test LAMMPS
	runs-on: ubuntu-latest
	steps:
	- uses: actions/checkout@v7
	- name: Set up uv
	uses: astral-sh/setup-uv@v7
	with:
	enable-cache: true
	cache-dependency-glob: \|
	*/requirements.txt
	**/pyproject.toml
	- name: Set up Python
	uses: actions/setup-python@v6
	with:
	python-version: 3.12
	- name: Install dependencies
	run: uv pip install nox[uv]
	- name: Test with LAMMPS
	run: nox -db uv -s lammps

	pass:
	name: Pass testing Python
	needs: [build, lammps]
	runs-on: ubuntu-latest
	if: always()
	steps:
	- name: Decide whether the needed jobs succeeded or failed
	uses: re-actors/alls-green@release/v1
	with:
	jobs: ${{ toJSON(needs) }}

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