Update readme for usage (#23) #9
Workflow file for this run
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| name: Build and upload to PyPi | |
| on: | |
| push: | |
| tags: | |
| - "*" | |
| release: | |
| types: | |
| - published | |
| workflow_dispatch: | |
| jobs: | |
| testpypi_push: | |
| environment: | |
| name: deploy | |
| url: https://test.pypi.org/p/openff-nagl-models/ | |
| permissions: | |
| id-token: write | |
| if: "github.repository == 'openforcefield/openff-nagl-models'" | |
| name: Build, upload and test pure Python wheels to TestPyPI | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v4 | |
| - name: testpypi_deploy | |
| uses: MDAnalysis/pypi-deployment@main | |
| if: github.event_name == 'push' && startsWith(github.ref, 'refs/tags/') | |
| with: | |
| test_submission: true | |
| package_name: 'openff-nagl-models' | |
| module_name: 'openff.nagl_models' | |
| wheels: false | |
| pypi_push: | |
| environment: | |
| name: deploy | |
| url: https://pypi.org/p/openff-nagl-models/ | |
| permissions: | |
| id-token: write | |
| if: "github.repository == 'openforcefield/openff-nagl-models'" | |
| name: Build, upload and test pure Python wheels to PyPI | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v4 | |
| - name: pypi_deploy | |
| uses: MDAnalysis/pypi-deployment@main | |
| if: github.event_name == 'release' && github.event.action == 'published' | |
| with: | |
| package_name: 'openff-nagl-models' | |
| module_name: 'openff.nagl_models' | |
| wheels: false |