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/requirements.txt
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--- a +++ b/requirements.txt @@ -0,0 +1,13 @@ +torch>=1.8.0 +torch-scatter>=2.0.8 +torch-cluster>=1.5.9 +decorator +numpy>=1.11 +rdkit-pypi>=2020.9 +matplotlib +tqdm +networkx +ninja +jinja2 +lmdb +fair-esm \ No newline at end of file