GraphNVP: An Invertible Flow Model for Generating Molecular Graphs

28 May 2019Kaushalya MadhawaKatushiko IshiguroKosuke NakagoMotoki Abe

We propose GraphNVP, the first invertible, normalizing flow-based molecular graph generation model. We decompose the generation of a graph into two steps: generation of (i) an adjacency tensor and (ii) node attributes... (read more)

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