lucas-morin
commented
4 months ago The gc_gcn_model available does not support the recognition of superatoms (as well as atom charges).
For such molecules, please use gc_no_stereo_model or gc_stereo_model.
Best, Lucas
sincelover
Hi, dear developers! Thank you very much for code sharing!
When I use gc_gcn_model to make predictions, almost all of the results appear to have Superatom Groups Recognition Error.An example is shown below. But no such problem occurs when I use the other two models. I wonder if there's a problem with the ocr settings.
image:
result:
