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fix: update gp_params for bayes opt #149

fix: update gp_params for bayes opt

fix: update gp_params for bayes opt #149

Workflow file for this run

name: Codecov workflow
on: [push, pull_request]
jobs:
run:
runs-on: ubuntu-latest
steps:
- name: Checkout
uses: actions/checkout@v2
- name: Set up Python 3.10
uses: actions/setup-python@v2
with:
python-version: '3.10'
- name: Install dependencies
run: |
python -m pip install --upgrade pip
python -m pip install ase cclib matplotlib numpy scipy ray
python -m pip install umap-learn psutil bayesian-optimization qcelemental
python -m pip install pandas
python -m pip install pytest-cov
- name: Run tests and collect coverage
run: pytest --cov=mbgdml
- name: Upload coverage to Codecov
uses: codecov/codecov-action@v3