This repo contains a reference implementation for GraphAF as described in the paper:
GraphAF: a Flow-based Autoregressive Model for Molecular Graph Generation
Chence Shi*, Minkai Xu*, Zhaocheng Zhu, Weinan Zhang, Ming Zhang, Jian Tang
International Conference on Learning Representations (ICLR), 2020.
Paper: https://arxiv.org/abs/2001.09382
Code is available at google drive now.
Update: We implement the GraphAF in our TorchDrug platform.