osbm commited on
Commit
ff2edc5
·
1 Parent(s): 5bf5a53
Files changed (1) hide show
  1. app.py +4 -0
app.py CHANGED
@@ -150,6 +150,9 @@ if submitted:
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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,
@@ -157,6 +160,7 @@ if submitted:
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  maxMols=len(selected_molecules),
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  # legends=None,
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  returnPNG=False,
 
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  )
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  print(type(molecule_image))
 
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  selected_molecules = [Chem.MolFromSmiles(mol) for mol in selected_molecules]
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  # IPythonConsole.UninstallIPythonRenderer()
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+ drawOptions = Draw.rdMolDraw2D.MolDrawOptions()
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+ drawOptions.prepareMolsBeforeDrawing = False
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+
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  molecule_image = Draw.MolsToGridImage(
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  selected_molecules,
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  molsPerRow=3,
 
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  maxMols=len(selected_molecules),
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  # legends=None,
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  returnPNG=False,
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+ drawOptions=drawOptions,
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  )
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  print(type(molecule_image))