MolScribe: Robust Molecular Structure Recognition with Image-to-Graph Generation

MolScribe: Robust Molecular Structure Recognition with Image-to-Graph Generation

Molecular structure recognition is the task of translating a molecular image into its graph structure. Significant variation in drawing styles and conventions exhibited in chemical literature poses a significant challenge for automating this task. In this paper, we propose MolScribe, a novel image-t...

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Bibliographic Details
Main Authors: Qian, Yujie, Guo, Jiang, Tu, Zhengkai, Li, Zhening, Coley, Connor W, Barzilay, Regina
Other Authors: Massachusetts Institute of Technology. Computer Science and Artificial Intelligence Laboratory
Format: Article
Language:English
Published: American Chemical Society 2025
Online Access:https://hdl.handle.net/1721.1/158192

Internet

https://hdl.handle.net/1721.1/158192

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