High-Throughput Measurement and Machine Learning-Based Prediction of Collision Cross Sections for Drugs and Drug Metabolites

[Image: see text] Drug metabolite identification is a bottleneck of drug metabolism studies due to the need for time-consuming chromatographic separation and structural confirmation. Ion mobility-mass spectrometry (IM-MS), on the other hand, separates analytes on a rapid (millisecond) time scale and...

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Detalles Bibliográficos
Autores principales: Ross, Dylan H., Seguin, Ryan P., Krinsky, Allison M., Xu, Libin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9165597/
https://www.ncbi.nlm.nih.gov/pubmed/35548857
http://dx.doi.org/10.1021/jasms.2c00111

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9165597/
https://www.ncbi.nlm.nih.gov/pubmed/35548857
http://dx.doi.org/10.1021/jasms.2c00111

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