We read every piece of feedback, and take your input very seriously.
To see all available qualifiers, see our documentation.
1 parent ab20a3f commit 533c770Copy full SHA for 533c770
.github/workflows/test.yml
@@ -63,12 +63,8 @@ jobs:
63
echo "RDBASE: $RDBASE"
64
echo "PATH: $PATH"
65
python -c "import rdkit; print('RDKit version:', rdkit.__version__)"
66
- micromamba activate graphium
67
- micromamba uninstall rdkit
68
- micromamba install rdkit=2024.03.4
69
- which python
70
- python -c "import rdkit; print('RDKit version:', rdkit.__version__)"
71
- micromamba run -n graphium pytest
+ mamba list rdkit
+ pytest
72
73
- name: Test CLI
74
run: graphium --help
0 commit comments