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Updated: Jun 5, 2025

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以反应类型得分为指导的化学酶合成规划

Hongxiang Li1,2,3,4, Xuan Liu1,2,3, Guangde Jiang2,3,5

  • 1NSF Molecule Maker Lab Institute, University of Illinois at Urbana-Champaign, Urbana, Illinois 61801, United States.

Journal of chemical information and modeling
|December 9, 2024
PubMed
概括

一个新的策略,反应类型评分 (RTscore) 引导的化学酶合成规划 (RTS-CESP),改善了化学合成规划. 它有效地识别了酶的步骤,以优化复杂的分子合成路径.

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