Bump up version #165

Workflow file for this run

.github/workflows/ci-python.yaml at 2c00b93

	# This file is autogenerated by maturin v1.4.0
	# To update, run
	#
	# maturin generate-ci github
	#
	name: Test Python implementation

	on:
	push:
	branches: [develop, main]
	tags:
	- '*'
	pull_request:
	branches: [develop, main]
	workflow_dispatch:

	permissions:
	contents: read
	packages: write # for uraimo/run-on-arch-action to cache docker images

	jobs:
	examples:
	runs-on: ubuntu-latest
	steps:
	- uses: actions/checkout@v4
	- uses: Swatinem/rust-cache@v2
	- name: Install uv
	uses: astral-sh/setup-uv@v3
	- uses: actions/setup-python@v4
	with:
	python-version: '3.10'
	- name: Build wheels
	uses: PyO3/maturin-action@v1
	with:
	args: --release --out dist --manifest-path moyopy/Cargo.toml
	sccache: 'true'
	manylinux: auto
	- uses: actions/cache@v3
	with:
	path: ~/.cache/pip
	key: ${{ runner.os }}-pip-${{ hashFiles('moyopy/examples/requirements.txt') }}
	restore-keys: \|
	${{ runner.os }}-pip-
	- name: examples
	shell: bash
	run: \|
	set -e
	uv pip install --system --no-index --find-links dist moyopy
	uv pip install --system moyopy[interface]
	python moyopy/examples/basic.py
	python moyopy/examples/pymatgen_structure.py

	linux:
	runs-on: ubuntu-latest
	strategy:
	matrix:
	target: [x86_64, aarch64]
	steps:
	- uses: actions/checkout@v4
	- uses: Swatinem/rust-cache@v2
	- name: Install uv
	uses: astral-sh/setup-uv@v3
	- uses: actions/setup-python@v4
	with:
	python-version: '3.10'
	- name: Build wheels
	uses: PyO3/maturin-action@v1
	with:
	target: ${{ matrix.target }}
	args: --release --out dist --manifest-path moyopy/Cargo.toml
	sccache: 'true'
	manylinux: auto
	- name: Upload wheels
	uses: actions/upload-artifact@v4
	with:
	name: pypi-linux-${{ matrix.target }}
	path: dist
	- name: pytest
	if: ${{ startsWith(matrix.target, 'x86_64') }}
	shell: bash
	run: \|
	set -e
	uv pip install --system --no-index --find-links dist moyopy
	uv pip install --system moyopy[testing]
	pytest -v
	# TODO: too long to build...
	# - name: pytest
	# if: ${{ !startsWith(matrix.target, 'x86_64') }}
	# uses: uraimo/run-on-arch-action@v2
	# with:
	# arch: ${{ matrix.target }}
	# distro: ubuntu22.04
	# githubToken: ${{ github.token }}
	# install: \|
	# apt-get update -q -y
	# apt-get install -y --no-install-recommends gcc-aarch64-linux-gnu build-essential python3 python3-dev python3-pip
	# run: \|
	# set -e
	# pip install --no-index --find-links dist moyopy
	# pip install moyopy[testing]
	# pytest -v

	windows:
	runs-on: windows-latest
	strategy:
	matrix:
	target: [x64]
	steps:
	- uses: actions/checkout@v4
	- uses: Swatinem/rust-cache@v2
	- name: Install uv
	uses: astral-sh/setup-uv@v3
	- uses: actions/setup-python@v4
	with:
	python-version: '3.10'
	architecture: ${{ matrix.target }}
	- name: Build wheels
	uses: PyO3/maturin-action@v1
	with:
	target: ${{ matrix.target }}
	args: --release --out dist --manifest-path moyopy/Cargo.toml
	sccache: 'true'
	- name: Upload wheels
	uses: actions/upload-artifact@v4
	with:
	name: pypi-windows-${{ matrix.target }}
	path: dist
	- name: pytest
	shell: bash
	run: \|
	set -e
	uv pip install --system --find-links dist --force-reinstall -e moyopy[dev]
	cd moyopy && pytest -v

	macos:
	runs-on: macos-latest
	strategy:
	matrix:
	target: [x86_64, aarch64]
	steps:
	- uses: actions/checkout@v4
	- uses: Swatinem/rust-cache@v2
	- name: Install uv
	uses: astral-sh/setup-uv@v3
	- uses: actions/setup-python@v4
	with:
	python-version: '3.10'
	- name: Build wheels
	uses: PyO3/maturin-action@v1
	with:
	target: ${{ matrix.target }}
	args: --release --out dist --manifest-path moyopy/Cargo.toml
	sccache: 'true'
	- name: Upload wheels
	uses: actions/upload-artifact@v4
	with:
	name: pypi-macos-${{ matrix.target }}
	path: dist
	- name: pytest
	if: ${{ !startsWith(matrix.target, 'aarch64') }}
	shell: bash
	run: \|
	set -e
	uv pip install --system --find-links dist --force-reinstall -e moyopy[dev]
	cd moyopy && pytest -v

	sdist:
	runs-on: ubuntu-latest
	steps:
	- uses: actions/checkout@v4
	- uses: Swatinem/rust-cache@v2
	- name: Build sdist
	uses: PyO3/maturin-action@v1
	with:
	command: sdist
	args: --out dist --manifest-path moyopy/Cargo.toml
	- name: Upload sdist
	uses: actions/upload-artifact@v4
	with:
	name: pypi-sdist
	path: dist

	pass:
	name: ✅ Pass ci-python
	needs: [linux, windows, macos, sdist, examples]
	runs-on: ubuntu-latest
	steps:
	- name: Check all CI jobs
	uses: re-actors/alls-green@release/v1
	with:
	jobs: ${{ toJSON(needs) }}
	if: always()

	release:
	name: Release
	runs-on: ubuntu-latest
	if: "startsWith(github.ref, 'refs/tags/')"
	needs: [pass]
	environment: release
	permissions:
	id-token: write
	steps:
	- uses: actions/download-artifact@v4
	with:
	pattern: pypi-*
	merge-multiple: true
	path: dist
	- name: Publish package to TestPyPI
	uses: pypa/gh-action-pypi-publish@release/v1
	with:
	repository-url: https://test.pypi.org/legacy/
	attestations: false
	verbose: true
	- name: Publish package to PyPI
	uses: pypa/gh-action-pypi-publish@release/v1
	with:
	attestations: false
	verbose: true

	docs:
	runs-on: ubuntu-latest
	permissions:
	contents: write
	steps:
	- uses: actions/checkout@v4
	with:
	fetch-depth: 0
	- uses: Swatinem/rust-cache@v2
	- name: Install uv
	uses: astral-sh/setup-uv@v3
	- uses: actions/setup-python@v5
	with:
	python-version: "3.10"
	- name: Build wheels
	uses: PyO3/maturin-action@v1
	with:
	target: x86_64
	args: --release --out dist --manifest-path moyopy/Cargo.toml
	sccache: 'true'
	manylinux: auto
	- name: Install
	run: \|
	set -e
	uv pip install --system --no-index --find-links dist moyopy
	uv pip install --system moyopy[testing,docs]
	- name: Build
	run: \|
	sphinx-build moyopy/docs docs_build
	- name: Deploy
	if: ${{ github.event_name == 'push' }}
	uses: peaceiris/actions-gh-pages@v4
	with:
	github_token: ${{ secrets.GITHUB_TOKEN }}
	publish_dir: ./docs_build
	destination_dir: python

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Bump up version #165

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Bump up version #165

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Workflow file for this run