Search Results for author: Li Kai

Found 1 papers, 0 papers with code

Molecular design method based on novel molecular representation and variational auto-encoder

no code implementations20 Feb 2023 Li Kai, Li Ning, Zhang Wei, Gao Ming

Based on the traditional VAE, a novel neural network model is presented, with the latest molecular representation, SELFIES, to improve the effect of generating new molecules.

molecular representation

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