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Applied same refactor to reaction data loader #100

Applied same refactor to reaction data loader

Applied same refactor to reaction data loader #100

Workflow file for this run

name: build
on:
push:
paths-ignore:
- "README.md"
- "docs/**"
pull_request:
paths-ignore:
- "README.md"
- "docs/*"
- "CHANGELOG.md"
- "CONTRIBUTORS.md"
- "CONTRIBUTING.md"
- "imgs/"
jobs:
build_cpu:
runs-on: ubuntu-18.04
strategy:
matrix:
python-version: [3.7, 3.8, 3.9, 3.11]
steps:
- name: Checkout repository
uses: actions/checkout@v2
# See: https://github.com/marketplace/actions/setup-conda
- name: Setup anaconda
uses: s-weigand/setup-conda@v1
with:
python-version: ${{ matrix.python-version }}
conda-channels: "conda-forge"
- name: Install GAUCHE
run: pip install -e .
- name: Install rnxfp
run: pip install --no-deps rxnfp
- name: Install drfp
run: pip install --no-deps drfp
- name: Install transformers
run: pip install transformers
- name: Run unit tests and generate coverage report
run: pytest .
- name: Test notebook execution
run: pytest --nbval-lax notebooks/ --current-env