README.md

metadata

license: mit

All-atom Diffusion Transformers - QMOF150 dataset

QMOF150 dataset from the paper "All-atom Diffusion Transformers: Unified generative modelling of molecules and materials", by Chaitanya K. Joshi, Xiang Fu, Yi-Lun Liao, Vahe Gharakhanyan, Benjamin Kurt Miller, Anuroop Sriram*, and Zachary W. Ulissi* from FAIR Chemistry at Meta (* Joint last author).

Original data source: https://github.com/Andrew-S-Rosen/QMOF

GitHub: https://github.com/facebookresearch/all-atom-diffusion-transformer