GraphAF: a Flow-based Autoregressive Model for Molecular Graph Generation

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.