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Update app.py
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app.py
CHANGED
@@ -189,8 +189,9 @@ def rgb_to_hex(rgb):
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return '#{:02x}{:02x}{:02x}'.format(rgb[0], rgb[1], rgb[2])
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def mol_to_pharm3d(mol
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AllChem.Compute2DCoords(mol)
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feats = FEAT_FACTORY.GetFeaturesForMol(mol)
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return '#{:02x}{:02x}{:02x}'.format(rgb[0], rgb[1], rgb[2])
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def mol_to_pharm3d(mol):
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if mol is None:
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return
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AllChem.Compute2DCoords(mol)
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feats = FEAT_FACTORY.GetFeaturesForMol(mol)
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