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Datasets:
YinkaiW
/
pubchem-faiss-library

Languages:
English
Tags:
faiss
retrieval
cheminformatics
smiles
pubchem
License:
Dataset card Files Files and versions
xet
Community
pubchem-faiss-library / code /FLARE /flare
229 kB
  • 1 contributor
History: 1 commit
YinkaiW's picture
YinkaiW
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  • data
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  • models
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  • subformula_assign
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  • utils
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  • __init__.py
    0 Bytes
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  • cache_hf_mol_embeddings_umap.py
    11.9 kB
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  • cache_mol_embeddings_umap.py
    7.93 kB
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  • data_preprocess.py
    2.56 kB
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  • definitions.py
    1.88 kB
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  • evaluate_results.py
    1.34 kB
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  • run.sh
    712 Bytes
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  • run_hf_mol_umap.sh
    408 Bytes
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  • test.py
    8.71 kB
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  • train.py
    4.5 kB
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  • tune.py
    9.6 kB
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