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Updated: Jun 6, 2025

Mass Spectrometry-Guided Genome Mining as a Tool to Uncover Novel Natural Products
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使用前体-产物离子对图的图形嵌入来预测小分子的并列质谱

Fujian Zheng1,2,3, Lei You1,2,3, Xinjie Zhao1,2,3

  • 1CAS Key Laboratory of Separation Science for Analytical Chemistry, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, 457 Zhongshan Road, Dalian 116023, China.

Analytical chemistry
|November 22, 2024
PubMed
概括

PPGB-MS2通过将碎片化转化为强度预测来提高双重质谱 (MS/MS) 预测的准确性. 这种方法通过更好地将预测的MS / MS数据与化学结构相关联,提高了代谢学识别.

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