Hello,
Is it possible to display a molecule image directly in an IPython console (not
a Jupyter Notebook)? Or maybe I need to send the image file directly to my
image viewer? I would like to be able to quickly view the molecules without
using a Jupyter Notebook or having to save the PNGs. For example:
In [6]: from rdkit import Chem
...: from rdkit.Chem.Draw import IPythonConsole
...: from rdkit.Chem import Draw
In [7]: m = Chem.MolFromSmiles('c1ncncc1C(=O)[O-]')
In [8]: m
Out[8]: <rdkit.Chem.rdchem.Mol at 0x....>
In [9]: Chem.Draw.MolToImage(m)
Out[9]: <PIL.PngImagePlugin.PngImageFile image mode=RGB size=300x300 at 0x...>
Thanks for your help.
Vin
---
Vincent F. Scalfani
The University of Alabama
<mailto:[email protected]>
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