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

Beck AG, Anyaeche RO, Wijewardhane P, Iyer S, Fu Y, Kuan-Yu Liu J, Zhang J, Alzarieni KZ, Feng E, Hilger RT, Welch C, Kenttämaa HI, Chopra G.

Open source

DOI
10.1039/d5sc07324c
Published
2026-06-02
Container
Chem Sci
Publisher
Not recorded
Open access
yes

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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 = {Beck AG and  Anyaeche RO and  Wijewardhane P and  Iyer S and  Fu Y and  Kuan-Yu Liu J and  Zhang J and  Alzarieni KZ and  Feng E and  Hilger RT and  Welch C and  Kenttämaa HI and  Chopra G.},
  year = {2026},
  journal = {Chem Sci},
  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  - Beck AG
AU  -  Anyaeche RO
AU  -  Wijewardhane P
AU  -  Iyer S
AU  -  Fu Y
AU  -  Kuan-Yu Liu J
AU  -  Zhang J
AU  -  Alzarieni KZ
AU  -  Feng E
AU  -  Hilger RT
AU  -  Welch C
AU  -  Kenttämaa HI
AU  -  Chopra G.
PY  - 2026
JO  - Chem Sci
DO  - 10.1039/d5sc07324c
UR  - https://doi.org/10.1039/d5sc07324c
ER  - 

APA

AG, B., RO, A., P, W., S, I., Y, F., J, K. L., J, Z., KZ, A., E, F., RT, H., C, W., HI, K., & G., C. (2026). Interpretable machine learning-based automated HPLC/MS<sup>2</sup> platform using ion-molecule reactions for the identification of functionalities in analytes.. Chem Sci. https://doi.org/10.1039/d5sc07324c

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