DOI: 10.1039/d4ra06695b ISSN: 2046-2069

Modeling the relative response factor of small molecules in positive electrospray ionization

Dimitri Abrahamsson, Lelouda-Athanasia Koronaiou, Trevor Johnson, Junjie Yang, Xiaowen Ji, Dimitra A. Lambropoulou

This study introduces a novel computational method for modeling the ionization efficiency of small molecules in positive electrospray ionization, designed to facilitate the semi-quantification of chemicals in the absence of analytical standards.

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