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Updated: Jun 25, 2026

Hierarchical and Programmable One-Pot Oligosaccharide Synthesis
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计算管道,以加速糖仿制剂的设计

Yao Xiao1, Alexander H Lee1, Sawsan Mahmoud1

  • 1Complex Carbohydrate Research Center, University of Georgia, 315 Riverbend Rd, Athens, Georgia 30605, United States.

Journal of chemical information and modeling
|November 27, 2025
PubMed
概括

这项研究引入了一个计算管道,用于设计糖相对应抑制剂,自动化模拟创建和能量计算. 该方法准确地预测了分子方向,有助于开发新的基于碳水化合物的药物.

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