Deployment - QCArchive Prod Docker Environments #43
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| # deployment of qcarchive prod environments for docker deployments | |
| name: Deployment - QCArchive Prod Docker Environments | |
| on: | |
| # run once prod env deployments are in place | |
| #workflow_run: | |
| # workflows: ["Deployment - QCArchive Prod Environments"] | |
| # branches: [master] | |
| # types: | |
| # - completed | |
| workflow_dispatch: | |
| jobs: | |
| build-deploy-docker: | |
| runs-on: ubuntu-latest | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| env-name: | |
| #- qcarchive-worker-openff-ani | |
| #- qcarchive-worker-openff-openmm | |
| - qcarchive-worker-openff-psi4 | |
| - qcarchive-worker-openff-psi4-ddx | |
| #- qcarchive-worker-openff-xtb | |
| steps: | |
| - name: Checkout code | |
| uses: nschloe/action-cached-lfs-checkout@v1 | |
| - name: ensure we only have one instance running | |
| uses: softprops/turnstyle@master | |
| env: | |
| GITHUB_TOKEN: ${{ secrets.GH_DANGERBOT_TOKEN_LIMITED }} | |
| with: | |
| abort-after-seconds: 60 | |
| - name: Log in to the Container registry | |
| uses: docker/login-action@65b78e6e13532edd9afa3aa52ac7964289d1a9c1 | |
| with: | |
| registry: ghcr.io | |
| username: ${{ github.actor }} | |
| password: ${{ secrets.GITHUB_TOKEN }} | |
| - name: Inject environment name into Dockerfile | |
| shell: bash | |
| env: | |
| ENV_NAME: ${{ matrix.env-name }} | |
| BUILD_DIR: ./devtools/docker/qcarchive-worker-openff | |
| run: | | |
| mkdir ${BUILD_DIR}/tmp/ | |
| envsubst < ${BUILD_DIR}/Dockerfile > ${BUILD_DIR}/tmp/Dockerfile | |
| cat ${BUILD_DIR}/tmp/Dockerfile | |
| - name: Build and push Docker images | |
| uses: docker/build-push-action@v6 | |
| with: | |
| context: . | |
| push: true | |
| tags: ghcr.io/${{ github.repository }}:${{ matrix.env-name }}-latest | |
| file: ./devtools/docker/qcarchive-worker-openff/tmp/Dockerfile | |
| #path: ./devtools/docker/qcarchive-worker-openff/tmp/ | |
| #username: ${{ secrets.DOCKERHUB_USERNAME }} | |
| #password: ${{ secrets.DOCKERHUB_PASSWORD }} | |
| #repository: openforcefield/${{ matrix.env-name }} | |
| #add_git_labels: true | |
| #tag_with_ref: true | |
| #tag_with_sha: true |