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MOFjson: An Explicit Topological Representation of Metal-Organic Frameworks for Language Models

Yong, Anabel et al.
arXiv (All) · Papers
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machine-learningsoftware-engineering
Language models for metal-organic frameworks (MOFs) rely on formats that separate atomic geometry from structural topology, forcing models to choose between unstructured coordinate lists and non-spatial string identifiers[1]. We present MOFjson, the first representation separating structural data in
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