Create place_a_dockerfile_in_current_eos_repo.py #407

	name: Deploy and test ersilia on PR

	on:
	pull_request:
	branches: [ master ]
	push:
	branches: [ master ]

	workflow_dispatch:

	permissions:
	contents: read

	jobs:
	build:
	runs-on: ubuntu-latest
	steps:
	- uses: actions/checkout@8f4b7f84864484a7bf31766abe9204da3cbe65b3 # [email protected]

	- name: Add conda to system path
	run: echo $CONDA/bin >> $GITHUB_PATH

	- name: Source conda
	run: source $CONDA/etc/profile.d/conda.sh

	- name: Install dependencies
	run: \|
	source activate
	conda init
	conda install git-lfs -c conda-forge
	git-lfs install
	conda install gh -c conda-forge

	- name: Install ersilia
	run: \|
	source activate
	python --version
	echo "After conda init"
	conda init
	python -m pip install -e .[test]

	- name: Deploy models
	run: \|
	source activate
	ersilia fetch molecular-weight
	echo "Serving molecular-weight model."
	ersilia serve molecular-weight
	ersilia api calculate -i "CC(=O)OC1=CC=CC=C1C(=O)O" \| grep "180.15899"

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