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SMILES_Generation_and_Prediction
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SMILES_Generation_and_Prediction
33.2 MB
  • 1 contributor
History: 9 commits
Raykarr's picture
Raykarr
Update app.py
b4730a3 verified about 1 year ago
  • .gitattributes
    1.56 kB
    Upload 11 files about 1 year ago
  • GCN_final_model.pth
    142 kB
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  • GCN_model.pth
    142 kB
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  • GIN_final_model.pth
    117 kB
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  • GIN_model.pth
    117 kB
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  • README.md
    256 Bytes
    initial commit about 1 year ago
  • app.py
    27 kB
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  • data_norm.pth
    1.44 kB
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  • gan_mol_dict.pth
    697 kB
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  • qm9.csv
    29.9 MB
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  • requirements.txt
    330 Bytes
    Update requirements.txt about 1 year ago
  • vae_model.pth
    2.08 MB
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  • vae_vocab.pkl
    154 Bytes
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