Update with how pyscf works now #140
Workflow file for this run
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| name: Build | |
| on: [push, pull_request] | |
| jobs: | |
| build_linux_wheels: | |
| name: Build wheels on linux | |
| runs-on: ubuntu-20.04 | |
| steps: | |
| - uses: actions/checkout@v2 | |
| - name: Build wheels | |
| uses: pypa/[email protected] | |
| env: | |
| CIBW_SKIP: "*-musllinux_*" | |
| CIBW_ARCHS_LINUX: x86_64 | |
| CIBW_BEFORE_ALL_LINUX: > | |
| yum install -y eigen3-devel && | |
| yum install -y wget && | |
| wget https://support.hdfgroup.org/ftp/HDF5/releases/hdf5-1.12/hdf5-1.12.1/src/hdf5-1.12.1.tar.gz && | |
| tar zxvf hdf5-1.12.1.tar.gz && | |
| cd hdf5-1.12.1 && | |
| ./configure --prefix=/opt/rh/devtoolset-10/root/usr/ --enable-cxx && | |
| make && | |
| make install && | |
| yum install -y python3-devel && | |
| cd .. | |
| - uses: actions/upload-artifact@v2 | |
| with: | |
| path: ./wheelhouse/*.whl | |
| build_intelmac_wheels: | |
| name: Build wheels on intel mac | |
| runs-on: macos-11 | |
| steps: | |
| - uses: actions/checkout@v2 | |
| - name: Build wheels | |
| uses: pypa/[email protected] | |
| env: | |
| CIBW_ARCHS_MACOS: x86_64 | |
| CIBW_BEFORE_ALL_MACOS: > | |
| brew install eigen gcc wget && | |
| wget https://support.hdfgroup.org/ftp/HDF5/releases/hdf5-1.12/hdf5-1.12.1/src/hdf5-1.12.1.tar.gz && | |
| tar zxvf hdf5-1.12.1.tar.gz && | |
| cd hdf5-1.12.1 && | |
| ./configure --prefix=/usr/local/hdf5 --enable-cxx && | |
| sudo make && | |
| sudo make install && | |
| cd .. | |
| CIBW_ENVIRONMENT_MACOS: CC=gcc-11 CXX=g++-11 HDF5_ROOT=/usr/local/hdf5 | |
| - uses: actions/upload-artifact@v2 | |
| with: | |
| path: ./wheelhouse/*.whl | |
| make_sdist: | |
| name: Make sdist | |
| runs-on: ubuntu-20.04 | |
| steps: | |
| - uses: actions/checkout@v2 | |
| with: | |
| fetch-depth: 0 # Optional, use if you use setuptools_scm | |
| submodules: true # Optional, use if you have submodules | |
| - name: Install system dependencies | |
| run: | | |
| sudo apt-get -y install libhdf5-serial-dev | |
| sudo apt-get -y install libeigen3-dev | |
| sudo apt-get -y install cmake | |
| - name: Build SDist | |
| run: pipx run build --sdist | |
| - uses: actions/upload-artifact@v2 | |
| with: | |
| path: dist/*.tar.gz |