Hello,

Congrats on this work. It is quite interesting.

I have some doubts on it. May you help me?
I was able to run the pre-trained models (checkpoints). A pickle is generated, but how to use this pickle to generate the SDF file for the particular molecule?

I noticed that a 2D molecule is generated in this pickle...How to include the conformers -- like an SDF -- so I can use the output 3D molecule?

Cheers,

Alex