Mufei Li

Results 14 issues of Mufei Li

The temporary goal is to have a colab notebook for training a [DiGress](https://arxiv.org/abs/2209.14734) model on QM9 and using it to generate samples.

Work Item

## 🐛 Bug ## To Reproduce Steps to reproduce the behavior: ```bash pip install torch==1.12.0+cu116 torchvision==0.13.0+cu116 torchaudio==0.12.0 --extra-index-url https://download.pytorch.org/whl/cu116 conda install -c dglteam/label/cu116 dgl pip install ogb pip install torchmetrics...

bug:confirmed
has workaround

@rbharath @peastman I notice that the RMSE values I am getting for HPPB are more than 17. I guess we also need to take logarithm for this dataset.

@rbharath @miaecle This PR is for two submissions (random forest + ECFP & GCN + GC) on Clearance. Also, it seems that the dataset is small and the labels can...