vgsatorras / egnn

MIT License
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extrapolation on other datasets #12

Open LingsparkQ opened 2 years ago

LingsparkQ commented 2 years ago

I am wondering whether you could provide a tutorial concerning how to extrapolate egnn on another dataset, saying alchemy. You, your group, have done quite a good job so that the code could be run so automatically. But on the other hand, this set some obstacles when I am trying to extrapolate your model on another datasets.