Forked NVIDIA's code for SE(3) Equivariant GNN to modify it for molecular property (specific protein binding affinity) prediction on a custom dataset for the NeurIPS 2024 Leash Bio Kaggle Competition. My code and modifications are in the leash-bio branch.
ndriggs/DeepLearningExamples
Folders and files
| Name | Name | Last commit date | ||
|---|---|---|---|---|
Repository files navigation
Releases
No releases published
Languages
- Jupyter Notebook 50.0%
- Python 43.3%
- Shell 2.8%
- C++ 2.3%
- Cuda 1.1%
- Makefile 0.2%
- Other 0.3%