Interpretable machine learning-based automated HPLC/MS <sup>2</sup> platform using ion–molecule reactions for the identification of functionalities in analytes

Armen G. Beck, Ruth O. Anyaeche, Prageeth Wijewardhane, Sanjay Iyer, Yue Fu, Judy Kuan-Yu Liu, Jifa Zhang, Kawthar Z. Alzarieni, Erlu Feng, Ryan T. Hilger, Christopher Welch, Hilkka I. Kenttämaa, Gaurav Chopra

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DOI: 10.1039/d5sc07324c
Published: 2026
Container: Chemical Science
Publisher: Royal Society of Chemistry (RSC)
Open access: unknown

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Cite this work

BibTeX

@article{allodium:10.1039/d5sc07324c,
  title = {Interpretable machine learning-based automated HPLC/MS
                    <sup>2</sup>
                    platform using ion–molecule reactions for the identification of functionalities in analytes},
  author = {Armen G. Beck and Ruth O. Anyaeche and Prageeth Wijewardhane and Sanjay Iyer and Yue Fu and Judy Kuan-Yu Liu and Jifa Zhang and Kawthar Z. Alzarieni and Erlu Feng and Ryan T. Hilger and Christopher Welch and Hilkka I. Kenttämaa and Gaurav Chopra},
  year = {2026},
  journal = {Chemical Science},
  doi = {10.1039/d5sc07324c},
  url = {https://doi.org/10.1039/d5sc07324c}
}

RIS

TY  - JOUR
TI  - Interpretable machine learning-based automated HPLC/MS
                    <sup>2</sup>
                    platform using ion–molecule reactions for the identification of functionalities in analytes
AU  - Armen G. Beck
AU  - Ruth O. Anyaeche
AU  - Prageeth Wijewardhane
AU  - Sanjay Iyer
AU  - Yue Fu
AU  - Judy Kuan-Yu Liu
AU  - Jifa Zhang
AU  - Kawthar Z. Alzarieni
AU  - Erlu Feng
AU  - Ryan T. Hilger
AU  - Christopher Welch
AU  - Hilkka I. Kenttämaa
AU  - Gaurav Chopra
PY  - 2026
JO  - Chemical Science
DO  - 10.1039/d5sc07324c
UR  - https://doi.org/10.1039/d5sc07324c
ER  -

APA

Beck, A. G., Anyaeche, R. O., Wijewardhane, P., Iyer, S., Fu, Y., Liu, J. K., Zhang, J., Alzarieni, K. Z., Feng, E., Hilger, R. T., Welch, C., Kenttämaa, H. I., & Chopra, G. (2026). Interpretable machine learning-based automated HPLC/MS <sup>2</sup> platform using ion–molecule reactions for the identification of functionalities in analytes. Chemical Science. https://doi.org/10.1039/d5sc07324c

Source records

crossref · retrieved 2026-11-10T10:11:41.096Z