Add numpy headers and github actions #1
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| #A* ------------------------------------------------------------------- | |
| #B* This file contains source code for running a GitHub automation | |
| #-* related to the build process of the PyMOL computer program | |
| #C* Copyright 2025 by Martin Urban. | |
| #D* ------------------------------------------------------------------- | |
| #E* It is unlawful to modify or remove this copyright notice. | |
| #F* ------------------------------------------------------------------- | |
| #G* Please see the accompanying LICENSE file for further information. | |
| #H* ------------------------------------------------------------------- | |
| #I* Additional authors of this source file include: | |
| #-* | |
| #-* | |
| #-* | |
| #Z* ------------------------------------------------------------------- | |
| name: Build wheel files for all UNIX like operating systems | |
| on: [push] | |
| env: | |
| VCPKG_ROOT: ${{ github.workspace }}/vendor/vcpkg | |
| jobs: | |
| build: | |
| strategy: | |
| matrix: | |
| os: [ubuntu-latest, macos-13, macos-14] | |
| python-version: ["3.11", "3.12"] | |
| runs-on: ${{ matrix.os }} | |
| steps: | |
| - name: Checkout repository | |
| uses: actions/checkout@v4 | |
| with: | |
| submodules: recursive | |
| - name: Initialize vcpkg | |
| run: | | |
| git clone https://github.com/Microsoft/vcpkg.git vendor/vcpkg | |
| - name: Setup Python ${{ matrix.python-version }} | |
| uses: actions/setup-python@v5 | |
| with: | |
| python-version: ${{ matrix.python-version }} | |
| - name: Create virtual environment | |
| run: | | |
| python -m venv .venv | |
| source .venv/bin/activate | |
| python -m pip install wheel setuptools # setuptools needed for Python >=3.12 | |
| python -m pip install -r requirements.txt | |
| - name: Bootstrap vcpkg | |
| run: ${{ env.VCPKG_ROOT }}/bootstrap-vcpkg.sh -disableMetrics | |
| - name: Install vcpkg dependencies | |
| run: | | |
| ${{ env.VCPKG_ROOT }}/vcpkg install | |
| - name: Build extension | |
| run: | | |
| source .venv/bin/activate | |
| python automations/my_automator.py setup dev-env | |
| export ARCH=$(uname -m) | |
| python -m build | |
| pip install dist/*.whl | |
| - name: Run pytest | |
| run: | | |
| source .venv/bin/activate | |
| pip install pytest | |
| cd tests/ | |
| pytest | |
| - name: Upload artifact | |
| uses: actions/upload-artifact@v4 | |
| with: | |
| name: PyMOL-wheel-${{ matrix.os }}-${{ matrix.python-version }} | |
| path: dist/*.whl |