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Update app.py
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app.py
CHANGED
@@ -168,7 +168,7 @@ if st.button('Generate Molecules'):
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# **Select only desired ADMET properties**
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admet_properties = [
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-
'
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'hydrogen_bond_donors', 'QED', 'ClinTox', 'hERG', 'BBB_Martins'
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]
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df_results_filtered = df_results[[
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# **Select only desired ADMET properties**
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admet_properties = [
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+
'molecular_weight', 'logP', 'hydrogen_bond_acceptors',
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'hydrogen_bond_donors', 'QED', 'ClinTox', 'hERG', 'BBB_Martins'
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]
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df_results_filtered = df_results[[
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