This is the official web page of the G-SphereNet method proposed in the following paper. Code is released in DIG package.
Youzhi Luo, Shuiwang Ji. "An Autoregressive Flow Model for 3D Molecular Geometry Generation from Scratch".
@inproceedings{
luo2022an,
title={An Autoregressive Flow Model for 3D Molecular Geometry Generation from Scratch},
author={Youzhi Luo and Shuiwang Ji},
booktitle={International Conference on Learning Representations},
year={2022},
url={https://openreview.net/forum?id=C03Ajc-NS5W}
}This work was supported in part by National Science Foundation grants IIS-1908220.