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Updated: Jun 13, 2025

Standardized Identification of Compound Structure in Tibetan Medicine Using Ion Trap Mass Spectrometry and Multiple-Stage Fragmentation Analysis
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Standardized Identification of Compound Structure in Tibetan Medicine Using Ion Trap Mass Spectrometry and Multiple-Stage Fragmentation Analysis

Published on: March 17, 2023

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碎片和几何意识到分子的标记化用于基于结构的药物设计,使用语言模型

Cong Fu, Xiner Li, Blake Olson

    ArXiv
    |September 10, 2024
    PubMed
    概括

    我们开发了Frag2Seq,这是一种使用语言模型 (LMs) 进行基于结构的药物设计 (SBDD) 的新方法. 这种方法产生具有高结合亲和力和采样效率的药物样分子.

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