Main Publications

  1. Samokhin A., Sholokhova A., Borisov R. Enabling direct access to proprietary GC-MS data through black-box reconstruction of the Chromatec binary format // Journal of Chromatography A. 2026. Vol. 1783. P. 467189.
  2. Samokhin A., Khrisanfov M. High-Throughput Mass Spectral Library Searching of Small Molecules in R with NIST MSPepSearch // Journal of the American Society for Mass Spectrometry. 2026. Vol. 37, № 1. P. 264–269.
  3. Pautova A.K., Popov A.Y., Samokhin A.S., Beloborodova N.V., Revelsky A.I. A 3D-Printed Micro-Solid-Phase Extraction Device with Hypercrosslinked Polystyrene Sorbents for Highly Reproducible Aromatic Acid Analysis in Blood Serum // International Journal of Molecular Sciences. 2026. Vol. 27, № 14. P. 6443.
  4. Khrisanfov M., Matyushin D., Samokhin A. Finding potentially erroneous entries in METLIN SMRT // Journal of Chromatography A. 2025. Vol. 1745. P. 465761.
  5. Sobolev P.D., Burnakova N.A., Revelsky A.I., Zakharchenko V.E., Beloborodova N.V., Pautova A.K. A sensitive method for the profiling of phenyl- and indole-containing metabolites in blood serum and cerebrospinal fluid samples of patients with severe brain damage using ultra-high-pressure liquid chromatography-tandem mass spectrometry // Journal of Pharmaceutical and Biomedical Analysis. 2025. Vol. 260. P. 116803.
  6. Nesterenko P.N., Samokhin A.S. 3D printing in analytical chemistry—Quo Vadis? // 3D Printing in Analytical Chemistry. Elsevier, 2025. P. 453–473.
  7. Samokhin A. The Identity Algorithm: How the Most Popular Electron Ionization Mass Spectral Library Search Engine Actually Works // Journal of the American Society for Mass Spectrometry. 2024. Vol. 35, № 12. P. 3178–3183.
  8. Khrisanfov M.D., Matyushin D.D., Samokhin A.S. A general procedure for finding potentially erroneous entries in the database of retention indices // Anal. Chim. Acta. 2023. Vol. 1297, P. 342375.
  9. Sobolev P.D., Burnakova N.A., Beloborodova N.V., Revelsky A.I., Pautova A.K. Analysis of 4-Hydroxyphenyllactic Acid and Other Diagnostically Important Metabolites of α-Amino Acids in Human Blood Serum Using a Validated and Sensitive Ultra-High-Pressure Liquid Chromatography-Tandem Mass Spectrometry Method // Metabolites. 2023. Vol. 13, № 11. P. 1128.
  10. Samokhin A.S., Matyushin D.D. How searching against multiple libraries can lead to biased results in GC/MS‐based metabolomics // Rapid Comm Mass Spectrometry. 2023. Vol. 37, № 3.
  11. Pautova A.K., Samokhin A.S., Beloborodova N.V., Revelsky A.I. Multivariate Prognostic Model for Predicting the Outcome of Critically Ill Patients Using the Aromatic Metabolites Detected by Gas Chromatography-Mass Spectrometry // Molecules. 2022. Vol. 27, № 15. P. 4784.
  12. Khrisanfov M., Samokhin A. A general procedure for rounding m/z values in low-resolution mass spectra // Rapid Comm Mass Spectrometry. 2022. Vol. 36, № 11.
  13. Pautova A., Burnakova N., Revelsky A. Metabolic Profiling and Quantitative Analysis of Cerebrospinal Fluid Using Gas Chromatography–Mass Spectrometry: Current Methods and Future Perspectives // Molecules. 2021. Vol. 26, № 12. P. 3597.
  14. Pautova A.K., Khesina Z.B., Litvinova T.N., Revelsky A.I., Beloborodova N. V. Metabolic profiling of aromatic compounds in cerebrospinal fluid of neurosurgical patients using microextraction by packed sorbent and liquid–liquid extraction with gas chromatography–mass spectrometry analysis // Biomed. Chromatogr. 2021. Vol. 35, № 2.
  15. Khesina Z.B., Iartsev S.D., Revelsky A.I., Buryak A.K. Microextraction by packed sorbent optimized by statistical design of experiment as an approach to increase the sensitivity and selectivity of HPLC-UV determination of parabens in cosmetics // J. Pharm. Biomed. Anal. 2021. Vol. 195. P. 113843.
  16. Moskvin L.N., Rodinkov О.V., Moskvin А.L., Spivakovskii V., Vlasov A.Y., Bugaichenko A.S., Samokhin А.S., Nesterenko P.N. Chromatomembrane preconcentration of phenols using a new 3D printed microflow cell followed by reversed‐phase HPLC determination // J. Sep. Sci. 2021. Vol. 44, № 12. P. 2449–2456.