Globally set RDKit to include all properties when pickling an RDKit Mol #1433
Workflow file for this run
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name: "mypy" | |
on: | |
pull_request: | |
branches: | |
- main | |
push: | |
branches: | |
- main | |
concurrency: | |
group: "${{ github.workflow }}-${{ github.ref }}" | |
cancel-in-progress: true | |
defaults: | |
run: | |
shell: bash -l {0} | |
jobs: | |
mypy: | |
runs-on: ubuntu-latest | |
steps: | |
- uses: actions/checkout@v4 | |
- name: "Setup Micromamba" | |
uses: mamba-org/setup-micromamba@v1 | |
with: | |
environment-file: environment.yml | |
environment-name: gufe | |
cache-environment: true | |
cache-downloads: true | |
create-args: >- | |
python=3.10 | |
rdkit=2023.09.5 | |
init-shell: bash | |
- name: "Install steps" | |
run: | | |
python -m pip install mypy | |
python -m pip install --no-deps -e . | |
- name: "Environment Information" | |
run: | | |
micromamba info -a | |
micromamba list | |
- name: "Lint with mypy" | |
run: mypy |