| # PACT-Net (NeurIPS 2025) | |
| ```python | |
| python main.py --model polyatomic --rep polyatomic --dataset esol | |
| ``` | |
| ``` | |
| @inproceedings{khorana2025pactnet, | |
| title = {Topological Feature Compression for Molecular Graph Neural Networks}, | |
| author = {Rahul Khorana}, | |
| booktitle = {Thirty-ninth Conference on Neural Information Processing Systems (NeurIPS 2025) Workshop on AI for Science}, | |
| year = {2025}, | |
| note = {Poster presentation} | |
| } | |
| ``` | |