Skip to content

Publish pyscfadlib

Publish pyscfadlib #41

name: Publish pyscfadlib
on:
release:
types:
- released
workflow_dispatch:
jobs:
publish_pypi_linux_x86:
name: publish linux_x86 wheels to pypi
runs-on: ubuntu-latest
environment: release
permissions:
id-token: write
steps:
- uses: actions/checkout@v4
- name: Build wheels
uses: pypa/cibuildwheel@v2.23.0
with:
package-dir: pyscfadlib
output-dir: pyscfadlib/wheelhouse
config-file: "{package}/pyproject.toml"
env:
CIBW_BUILD: cp311-*
CIBW_ARCHS_LINUX: x86_64
CIBW_BEFORE_ALL_LINUX: "{package}/tools/prepare_build_environment_linux.sh"
CIBW_ENVIRONMENT_LINUX: PATH="$PATH:/usr/local/cuda/bin" \
LD_LIBRARY_PATH="$LD_LIBRARY_PATH:/usr/local/cuda/lib64"
CIBW_CONFIG_SETTINGS_LINUX: "cmake.define.ENABLE_CUDA=ON"
- name: Upload wheels
uses: actions/upload-artifact@v4
with:
name: cibw_wheels_linux
path: pyscfadlib/wheelhouse/*.whl
overwrite: true
# publish_pypi_linux_aarch64:
# name: publish linux_aarch64 wheels to pypi
# runs-on: ubuntu-latest
#
# environment: release
# permissions:
# id-token: write
#
# steps:
# - uses: actions/checkout@v4
#
# - name: Set up QEMU
# uses: docker/setup-qemu-action@v3
# with:
# platforms: all
#
# - name: Build wheels
# uses: pypa/cibuildwheel@v2.23.0
# env:
# CIBW_ARCHS_LINUX: aarch64
# with:
# package-dir: pyscfadlib
# output-dir: pyscfadlib/wheelhouse
# config-file: "{package}/pyproject.toml"
#
# - name: Publish to PyPI
# uses: pypa/gh-action-pypi-publish@release/v1
# with:
# packages-dir: pyscfadlib/wheelhouse
#
# build_wheel_macos_x86:
# name: Build macos_x86 wheels
# runs-on: macos-13
#
# steps:
# - uses: actions/checkout@v4
#
# - name: Build wheels
# uses: pypa/cibuildwheel@v2.21.3
# env:
# MACOSX_DEPLOYMENT_TARGET: "10.14"
# with:
# package-dir: pyscfadlib
# output-dir: pyscfadlib/wheelhouse
# config-file: "{package}/pyproject.toml"
#
# - name: Upload wheels
# uses: actions/upload-artifact@v4
# with:
# name: cibw_wheels_macos_x86
# path: pyscfadlib/wheelhouse/*.whl
# overwrite: true
#
# build_wheel_macos_arm64:
# name: Build macos_arm64 wheels
# runs-on: macos-14
#
# steps:
# - uses: actions/checkout@v4
#
# - name: Build wheels
# uses: pypa/cibuildwheel@v2.21.3
# env:
# CMAKE_OSX_ARCHITECTURES: arm64;x86_64
# with:
# package-dir: pyscfadlib
# output-dir: pyscfadlib/wheelhouse
# config-file: "{package}/pyproject.toml"
#
# - name: Upload wheels
# uses: actions/upload-artifact@v4
# with:
# name: cibw_wheels_macos_arm64
# path: pyscfadlib/wheelhouse/*.whl
# overwrite: true
#
# publish_pypi_macos_x86:
# name: publish macos_x86 wheels to pypi
# needs: build_wheel_macos_x86
# runs-on: ubuntu-latest
#
# environment: release
# permissions:
# id-token: write
#
# steps:
# - name: Download wheels
# uses: actions/download-artifact@v4
# with:
# name: cibw_wheels_macos_x86
# path: dist
#
# - run: ls -R dist
#
# - name: Publish to PyPI
# uses: pypa/gh-action-pypi-publish@release/v1
#
# publish_pypi_macos_arm64:
# name: publish macos_arm64 wheels to pypi
# needs: build_wheel_macos_arm64
# runs-on: ubuntu-latest
#
# environment: release
# permissions:
# id-token: write
#
# steps:
# - name: Download wheels
# uses: actions/download-artifact@v4
# with:
# name: cibw_wheels_macos_arm64
# path: dist
#
# - run: ls -R dist
#
# - name: Publish to PyPI
# uses: pypa/gh-action-pypi-publish@release/v1
#