Bugfix: factor of 2 for dihedrals and impropers in ligpargen #24
Workflow file for this run
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| name: Release | |
| on: | |
| release: | |
| types: [published] | |
| branches: | |
| - "main" | |
| jobs: | |
| release: | |
| name: Release | |
| uses: molssi-seamm/devops/.github/workflows/Release.yaml@main | |
| with: | |
| src : forcefield_step | |
| secrets: inherit |