Checkpoints for QM9 only model?

#1
by ameya98 - opened

Hi Chaitanya, thanks for this implementation! Do you have checkpoints for a model trained on QM9 only?

Owner

I'm looking for it on my HPC. I do have wandb logs but can't locate the checkpoint at the moment. It takes 1 day on 2x A100s to train a decent model with validity hitting 96%+ (and 1 day more to get best results) so you could try to retrain yourself.

If its not urgent, I can also train the model for you in about 2 weeks time as I have some PhD-related deadlines.

PS. we also released 10K sampled molecules.

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