Ulrick Fineddie RANDRIHARIMANAMIZARA comments

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                                            Ulrick Fineddie RANDRIHARIMANAMIZARA

Some question about failure in recognization

Hello @sunyrain , So here the issue is that for the 5-membered ring to be aromatic, there must be a negative charge, which is not shown here. The predicted smiles...

Options for Not Expanding Abbreviated Structures During Prediction

Hello @zuhalcakir , Can you develop a bit on your goal? Because, in the current implementation, if there are abbreviated group, they are still stored in the prediction['molfile'] and the...