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app.py
CHANGED
@@ -149,15 +149,14 @@ if submitted:
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selected_molecules = random.choices(generated_molecule_list,k=12)
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selected_molecules = [Chem.MolFromSmiles(mol) for mol in selected_molecules]
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-
IPythonConsole.UninstallIPythonRenderer()
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molecule_image = Draw.MolsToGridImage(
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selected_molecules,
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molsPerRow=3,
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subImgSize=(250, 250),
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maxMols=len(selected_molecules),
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# legends=None,
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-
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returnPNG=False,
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)
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print(type(molecule_image))
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# print(type(molecule_image._data_and_metadata()))
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selected_molecules = random.choices(generated_molecule_list,k=12)
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selected_molecules = [Chem.MolFromSmiles(mol) for mol in selected_molecules]
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+
# IPythonConsole.UninstallIPythonRenderer()
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molecule_image = Draw.MolsToGridImage(
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selected_molecules,
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molsPerRow=3,
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subImgSize=(250, 250),
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maxMols=len(selected_molecules),
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# legends=None,
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+
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)
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print(type(molecule_image))
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# print(type(molecule_image._data_and_metadata()))
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