Added supercon model, added FF dataset for elements from Mlearn, early_stopping fix version update.
2022.11.06
- Fix pytorch version to match torchvision, which is necessary for atomvision - https://github.com/pytorch/vision/blob/cb60e97a778ad6626980b67c456984e5fcf1d507/README.rst#L22
2022.11.05
- ALIGNN-FF and ALIGNN-Evac model added. - Updated README
2022.10.23
- Added number of classes in alignn.
2022.09.22
- ALIGNN PhononDOS model added.
2022.01.25
- `get_multiple_predictions` added for high throughput predictions with trained ALIGNN models - Added note about QM9 results issue in README