metadata
license: apache-2.0
language:
- en
- ASUGNN.py: The pretrained ASUGNN model
- HMdataset.db: A zero-shot test dataset
You can test your model's zero-shot capability by predicting the formation energy per atom using the HMdataset (1,100 data) and upload your results on Kaggle : https://www.kaggle.com/competitions/asugnn.