使用基于质谱的代谢学,通过组装碎片签名,与结构解策略集成,识别异生生物转化产品

Yuan-Chih Chen1, Hsin-Yi Wu2, Wei-Sheng Wu3

  • 1Department of Environmental and Occupational Health, College of Medicine, National Cheng Kung University, Tainan 704, Taiwan.

Analytical chemistry
|September 15, 2023
PubMed
概括

这项研究介绍了FragAssembler,一种新的计算方法,用于准确识别外来生物生物转化产品. 这种方法显著减少了假阳性,提高了毒性和公共卫生监测的可靠性.

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