GattiMh

Thank you. In the Classification_inference.py, there's the `-tp` as a flag for the train_results_path. So I guess I should use that to load a pre-trained model? It seems it will...

Thanks. But if you want to use pre-trained models then why would you need to use the `train.py`? I thought you could have used the `inference.py` just by simply pointing...

How did you complete the installation at the end?

> > How did you complete the installation at the end? > > I didn't, that's why I wrote here. But by now, I am sorry to say, I have...

Thanks for uploading the package. I'm on an M1 mac and I still have the problem that no interactive features of the plots are basically happening. Any advices? Many thanks

> Sorry for the delay here, we've been quite busy with some other projects so maintenance on the chemwidgets package has fallen a bit behind. > > @johnberroa - Is...

Apologises for the delay. I solved the issue by following the guidelines in the Chemprop issues (https://github.com/chemprop/chemprop/issues/1169). Basically, I have installed chemprop separately changing the environment.yml to pytorch=2.5. Then, removed...

> Could you give a more detailed (step-wise) instruction? I don't see an environment.yml file in admet_ai...do you mean the requirements.txt? > > Thanks/Evert Yes apologises for the confusion. -...