add download to pre-loaded results
Browse files
app.py
CHANGED
@@ -160,6 +160,10 @@ def retrieval():
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mol = Chem.MolFromSmiles(results.loc[j + 5*i, 'SMILES'])
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mol_img = Chem.Draw.MolToImage(mol)
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st.image(mol_img, caption=f"{results.loc[j + 5*i, 'Prediction']:.2f}")
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elif query_embedding is not None:
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st.markdown('### Inference')
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mol = Chem.MolFromSmiles(results.loc[j + 5*i, 'SMILES'])
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mol_img = Chem.Draw.MolToImage(mol)
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st.image(mol_img, caption=f"{results.loc[j + 5*i, 'Prediction']:.2f}")
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+
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st.download_button('Download retrieved drug compounds.', convert_df(results.head(selected_k)), file_name='retrieved_drugs.csv')
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+
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st.markdown('## TMP title')
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elif query_embedding is not None:
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st.markdown('### Inference')
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