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Embedding of Molecular Structure Using Molecular Hypergraph Variational Autoencoder with Metric Learning
Koge, Daiki, ONO, Naoaki, Huang, Ming, Altaf-Ul-Amin, Md., Kanaya, ShigehikoJournal:
Molecular Informatics
DOI:
10.1002/minf.202000203
Date:
November, 2020
File:
PDF, 1.18 MB
2020