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JMorado · Nov 13, 2022 · 38459f1 · 38459f1
1 parent c98ce52
commit 38459f1
Showing 1 changed file with 3 additions and 4 deletions.
diff --git a/.github/workflows/python-package.yml b/.github/workflows/python-package.yml
@@ -25,10 +25,9 @@ jobs:
  python -m pip install --upgrade pip
  python -m pip install flake8 pytest
  if [ -f requirements.txt ]; then pip install -r requirements.txt; fi
- pip install conda
- conda create -n paramol_${{ matrix.python-version }} python=${{ matrix.python-version }}
- conda activate paramol_${{ matrix.python-version }}
- conda install paramol -c jmorado -c ambermd -c conda-forge -c omnia -c rdkit -c anaconda
+ $CONDA/bin/conda create -n paramol_${{ matrix.python-version }} python=${{ matrix.python-version }}
+ $CONDA/bin/conda activate paramol_${{ matrix.python-version }}
+ $CONDA/bin/conda install paramol -c jmorado -c ambermd -c conda-forge -c omnia -c rdkit -c anaconda
  - name: Lint with flake8
  run: |
  # stop the build if there are Python syntax errors or undefined names