mlip-arena / scripts /install-pyg.sh
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# PyTorch Geometric (OCP)
TORCH=2.2.0
CUDA=cu121
pip install --verbose --no-cache torch-scatter -f https://data.pyg.org/whl/torch-${TORCH}+${CUDA}.html
pip install --verbose --no-cache torch-sparse -f https://data.pyg.org/whl/torch-${TORCH}+${CUDA}.html