Deployment - QCArchive Prod Docker Environments #33

	---
	# 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-xtb
	steps:
	- name: Checkout code
	uses: nschloe/action-cached-lfs-checkout@v1

	- name: ensure we only have one instance running
	uses: softprops/turnstyle@v1
	env:
	GITHUB_TOKEN: ${{ secrets.GH_DANGERBOT_TOKEN_LIMITED }}
	with:
	abort-after-seconds: 60

	- 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@v1
	with:
	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

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