@article{molecularllmagentsfromarchitecturaldesig, title = {Molecular LLM Agents: From Architectural Design to Scientific Autonomy}, author = {Jiatong Li and Wengyu Zhang and Weida Wang and Yuxuan Ren and Wei Liu and Chenyang Mao and Yuqiang Li and Yatao Bian and Changmeng Zheng and Xiaoyong Wei and Qing Li}, year = {2026}, eprint = {2608.23104}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2608.23104}, }