"molecular graphs" Papers

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Bridging Molecular Graphs and Large Language Models

Runze Wang, Mingqi Yang, Yanming Shen

AAAI 2025paperarXiv:2503.03135
6
citations

From Sequence to Structure: Uncovering Substructure Reasoning in Transformers

Xinnan Dai, Kai Yang, Jay Revolinsky et al.

NEURIPS 2025arXiv:2507.10435
3
citations

Diffuse, Sample, Project: Plug-And-Play Controllable Graph Generation

Kartik Sharma, Srijan Kumar, Rakshit Trivedi

ICML 2024