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Make MODEL_SIZE_FILE always go in the model dest directory #1104

Make MODEL_SIZE_FILE always go in the model dest directory

Make MODEL_SIZE_FILE always go in the model dest directory #1104

Workflow file for this run

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@692973e3d937129bcbf40652eb9f2f61becf3332 # pin@v3.5.3
- name: Add conda to system path
run: echo $CONDA/bin >> $GITHUB_PATH
- name: Set Python to 3.10.10
run:
conda install -y python=3.10.10
- 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: Hub catalog
run: |
ersilia catalog
- name: Fetch model from GitHub
run: |
source activate
ersilia -v fetch molecular-weight --from_github
echo "Serving molecular-weight model."
ersilia serve molecular-weight
ersilia info
ersilia run -i "CC(=O)OC1=CC=CC=C1C(=O)O" | grep "180.15899"
ersilia close
- name: Fetch model from S3
run: |
source activate
ersilia -v fetch molecular-weight --from_s3
echo "Serving molecular-weight model."
ersilia serve molecular-weight
ersilia info
ersilia run -i "CC(=O)OC1=CC=CC=C1C(=O)O" | grep "180.15899"
ersilia close
- name: Fetch model from DockerHub
run: |
source activate
ersilia -v fetch molecular-weight --from_dockerhub
echo "Serving molecular-weight model."
ersilia serve molecular-weight
ersilia info
ersilia run -i "CC(=O)OC1=CC=CC=C1C(=O)O" | grep "180.15899"
ersilia close
- name: Local catalog
run: |
ersilia catalog --local