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作者

Jiawei Han

Data Mining

2026-03-03 至 2026-03-03 共收录 1
2505.12565 2026-03-03 cs.AI cs.CL cs.LG q-bio.QM

mCLM: A Modular Chemical Language Model that Generates Functional and Makeable Molecules

mCLM:一种模块化化学语言模型,能够生成功能性强且可制造的分子

Carl Edwards, Chi Han, Gawon Lee, Thao Nguyen, Sara Szymkuć, Chetan Kumar Prasad, Bowen Jin, Jiawei Han, Ying Diao, Ge Liu, Hao Peng, Bartosz A. Grzybowski, Martin D. Burke, Heng Ji

机构 * Siebel School of Computing and Data Science, University of Illinois Urbana-Champaign(伊利诺伊大学厄巴纳-香槟分校Siebel计算与数据科学学院) Department of Chemistry, University of Illinois Urbana-Champaign(伊利诺伊大学厄巴纳-香槟分校化学系) Allchemy Inc.(Allchemy公司) Department of Chemical and Biomolecular Engineering, University of Illinois Urbana-Champaign(伊利诺伊大学厄巴纳-香槟分校化学与生物分子工程系) Ulsan National Institute of Science and Technology(乌山国立科学技术研究院) Institute of Organic Chemistry, Polish Academy of Sciences(波兰科学院有机化学研究所)

AI总结 mCLM是一种模块化化学语言模型,通过功能构建模块生成具有功能性和可制造性的分子,提升合成可行性和药物研发效率。

Comments Accepted to ICLR 2026 (Oral). Code: https://github.com/blender-nlp/mCLM Data and Model: https://huggingface.co/collections/language-plus-molecules/mclm

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