Learning multimodal graph-to-graph translation for molecular optimization

© 7th International Conference on Learning Representations, ICLR 2019. All Rights Reserved. We view molecular optimization as a graph-to-graph translation problem. The goal is to learn to map from one molecular graph to another with better properties based on an available corpus of paired molecules....

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Bibliographic Details
Main Authors: Jin, W (Author), Yang, K (Author), Barzilay, R (Author), Jaakkola, T (Author)
Format: Article
Language:English
Published: 2021-11-05T11:41:49Z.
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