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add parsl as explicit dependency to enforce typeguard<3
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svandenhaute committed Feb 8, 2024
1 parent faaad86 commit 0a7ff04
Showing 1 changed file with 2 additions and 2 deletions.
4 changes: 2 additions & 2 deletions .github/workflows/run_pytest.yaml
Original file line number Diff line number Diff line change
Expand Up @@ -42,7 +42,7 @@ jobs:
pip install git+https://github.com/mir-group/allegro --no-deps
pip install git+https://github.com/svandenhaute/openmm-ml.git@triclinic
pip install pyscf
pip install 'psiflow[dev] @ git+https://github.com/molmod/psiflow.git'
pip install 'psiflow[parsl] @ git+https://github.com/molmod/psiflow.git'
cd ${{ runner.temp }} && git clone https://github.com/molmod/psiflow
cd psiflow
which cp2k.psmp
Expand Down Expand Up @@ -85,7 +85,7 @@ jobs:
pip install git+https://github.com/mir-group/allegro --no-deps
pip install git+https://github.com/svandenhaute/openmm-ml.git@triclinic
pip install pyscf
pip install 'psiflow[dev] @ git+https://github.com/molmod/psiflow.git'
pip install 'psiflow[parsl] @ git+https://github.com/molmod/psiflow.git'
cd ${{ runner.temp }} && git clone https://github.com/molmod/psiflow
cd psiflow
which cp2k.psmp
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