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try to install pygraphviz
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DanielYang59 committed Aug 5, 2024
1 parent bbdf250 commit b81a163
Showing 1 changed file with 3 additions and 2 deletions.
5 changes: 3 additions & 2 deletions .github/workflows/test.yml
Original file line number Diff line number Diff line change
Expand Up @@ -70,7 +70,7 @@ jobs:
- name: Install ubuntu-only conda dependencies
if: matrix.config.os == 'ubuntu-latest'
run: |
micromamba install -n pmg -c conda-forge enumlib packmol bader openbabel openff-toolkit --yes
micromamba install -n pmg -c conda-forge enumlib packmol bader openbabel openff-toolkit pygraphviz --yes
- name: Install pymatgen dependencies
run: |
Expand All @@ -82,10 +82,11 @@ jobs:
uv pip install cython setuptools wheel
- name: Install BoltzTraP2 on Ubuntu
- name: Install optional Ubuntu dependencies
if: matrix.config.os == 'ubuntu-latest'
run: |
micromamba activate pmg
# TODO: uv cannot install BoltzTraP2 (#3786),
# suggesting no NumPy when there is
pip install BoltzTraP2
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