From 875fae17b49230c9b3accb34d59de74b7cc94b47 Mon Sep 17 00:00:00 2001
From: Qiming Sun <osirpt.sun@gmail.com>
Date: Thu, 30 May 2024 22:15:19 -0700
Subject: [PATCH] Debug release workflow

---
 .github/workflows/publish.yml | 25 +++++++++++--------------
 1 file changed, 11 insertions(+), 14 deletions(-)

diff --git a/.github/workflows/publish.yml b/.github/workflows/publish.yml
index c749b79a..95f8ee5a 100644
--- a/.github/workflows/publish.yml
+++ b/.github/workflows/publish.yml
@@ -12,17 +12,17 @@ jobs:
       - uses: actions/checkout@v4
       - name: Build wheels
         run: |
-            docker run --rm -v ${{ github.workspace }}:/src/pyscf:rw --workdir=/src/pyscf \
+            docker run --rm -v ${{ github.workspace }}:/src/pyscf-forge:rw --workdir=/src/pyscf-forge \
             ${{ env.img }} \
             bash -exc '/opt/python/cp39-cp39/bin/pip install --upgrade pip setuptools && \
             yum install -y epel-release && \
             yum-config-manager --enable epel && \
             yum install -y openblas-devel gcc && \
-            export src=${GITHUB_WORKSPACE:-/src/pyscf} && \
-            export dst=${GITHUB_WORKSPACE:-/src/pyscf}/linux-wheels && \
+            export src=${GITHUB_WORKSPACE:-/src/pyscf-forge} && \
+            export dst=${GITHUB_WORKSPACE:-/src/pyscf-forge}/linux-wheels && \
             mkdir -p /root/wheelhouse $src/linux-wheels && \
             sed -i "/            if basename(fn) not in needed_libs:/s/basename.*libs/1/" /opt/_internal/pipx/venvs/auditwheel/lib/python*/site-packages/auditwheel/wheel_abi.py && \
-            /opt/python/cp39-cp39/bin/pip install pyscf && \
+            export PATH=/opt/python/cp39-cp39/bin:$PATH && \
             /opt/python/cp39-cp39/bin/pip wheel -v --no-deps --no-clean -w /root/wheelhouse $src && \
             export whl=`ls /root/wheelhouse/pyscf-*-linux_*.whl` && \
             auditwheel -v repair "$whl" --lib-sdir /lib -w $dst'
@@ -42,10 +42,6 @@ jobs:
 
   release-pypi-aarch64:
     runs-on: ubuntu-latest
-    strategy:
-      matrix:
-        pyver: [cp39-cp39]
-      fail-fast: false
     env:
       img: quay.io/pypa/manylinux2014_aarch64:2023-03-12-25fd859
     steps:
@@ -56,18 +52,19 @@ jobs:
       uses: docker/setup-qemu-action@v2
     - name: Build Wheel
       run: |
-            docker run --rm -v ${{ github.workspace }}:/src/pyscf:rw --workdir=/src/pyscf \
+            docker run --rm -v ${{ github.workspace }}:/src/pyscf-forge:rw --workdir=/src/pyscf-forge \
             ${{ env.img }} \
-            bash -exc '/opt/python/${{ matrix.pyver }}/bin/pip install --upgrade pip setuptools && \
+            bash -exc '/opt/python/cp39-cp39/bin/pip install --upgrade pip setuptools && \
             yum install -y epel-release && \
             yum-config-manager --enable epel && \
             yum install -y openblas-devel gcc && \
-            export src=${GITHUB_WORKSPACE:-/src/pyscf} && \
-            export dst=${GITHUB_WORKSPACE:-/src/pyscf}/linux-wheels && \
+            export src=${GITHUB_WORKSPACE:-/src/pyscf-forge} && \
+            export dst=${GITHUB_WORKSPACE:-/src/pyscf-forge}/linux-wheels && \
             mkdir -p /root/wheelhouse $src/linux-wheels && \
             sed -i "/            if basename(fn) not in needed_libs:/s/basename.*libs/1/" /opt/_internal/pipx/venvs/auditwheel/lib/python*/site-packages/auditwheel/wheel_abi.py && \
-            /opt/python/cp39-cp39/bin/pip install pyscf h5py==3.10 && \
-            /opt/python/${{ matrix.pyver }}/bin/pip wheel -v --no-deps --no-clean -w /root/wheelhouse $src && \
+            /opt/python/cp39-cp39/bin/pip install h5py==3.10 && \
+            export PATH=/opt/python/cp39-cp39/bin:$PATH && \
+            /opt/python/cp39-cp39/bin/pip wheel -v --no-deps --no-clean -w /root/wheelhouse $src && \
             export whl=`ls /root/wheelhouse/pyscf-*-linux_*.whl` && \
             auditwheel -v repair "$whl" --lib-sdir /lib -w $dst'
     - name: List available wheels