한국자기공명학회논문지 (Journal of the Korean Magnetic Resonance Society)

한국자기공명학회 (Korean Magnetic Resonance Society)
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Practical Guide to NMR-based Metabolomics - III : NMR Spectrum Processing and Multivariate Analysis

  • Jung, Young-Sang (Chong Kun Dang Research Institute, Chong Kun Dang Pharmaceutical Corp.)
  • 투고 : 2018.08.15
  • 심사 : 2018.09.03
  • 발행 : 2018.09.20
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초록

NMR-based metabolomics needs various knowledge to elucidate metabolic perturbation such as NMR experiments, NMR spectrum processing, raw data processing, metabolite identification, statistical analysis, and metabolic pathway analysis regarding technical aspects. Among them, some concepts of raw data processing and multivariate analysis are not easy to understand but are important to correctly interpret metabolic profile. This article introduces NMR spectrum processing, raw data processing, and multivariate analysis.

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참고문헌

  1. A. W. Overhauser, Phys. Rev. 92, 411 (1956)
  2. K. H. Hausser and D. Stehlik, Adv. Magn. Reson. 127, 79 (1968)
  3. E. R. McCarney, B. D. Armstrong, R. Kausik, and S. Han, Langmuir 24, 10062 (2008) https://doi.org/10.1021/la800334k
  4. C. P. Poole, Electron Spin Resonance: A Comprehensive Treatise on Experimental Techniques, Dover Publications (1983)
  5. S. I. Kwon, PhD dissertation "Multiferroic $Ba_{0.5}Sr_{1.5}Zn_2(Fe_{1-x}Al_x)_{12}O_{22}$ investigated by $^{57}Fe$ nuclear magnetic resonance" (2014)
  6. B. D. Armstrong and S. Han, J. Chem. Phys. 127, 104508 (2007) https://doi.org/10.1063/1.2770465
  7. J. M. Franck, A. Pavlova, J. A. Scott, and S. Han, Prog. Nucl. Magn. Reson. Spectrosc. 74, 33 (2013) https://doi.org/10.1016/j.pnmrs.2013.06.001
  8. A. Doll, E. Bordignon, B. Joseph, R. Tschaggelar, and G. Jeschke, J. Magn. Reson. 222, 34 (2012) https://doi.org/10.1016/j.jmr.2012.06.003
  9. M. E. Bollard, E. G. Stanley, J. C. Lindon, J. K. Nicholson, and E. Holmes, NMR Biomed 18, 143 (2005) https://doi.org/10.1002/nbm.935
  10. F. Dieterle, A. Ross, G. Schlotterbeck, and H. Senn, Anal. Chem. 78, 4281 (2006) https://doi.org/10.1021/ac051632c
  11. R. J. O. Torgrip, K. M. Åberg, E. Alm, I. Schuppe-Koistinen, and J. Lindberg, Metabolomics 4, 114 (2008) https://doi.org/10.1007/s11306-007-0102-2
  12. R. A. van den Berg, H. C. J. Hoefsloot, J. A. Westerhuis, A. K. Smilde, and M. J. van der Werf, BMC Genomics 7, 1 (2006) https://doi.org/10.1186/1471-2164-7-1
  13. H. C. Keun, T. M. D. Ebbels, H. Antti, M. E. Bollard, O. Beckonert, E. Holmes, J. C. Lindon, and J. K. Nicholson, Anal. Chim. Acta 490, 265 (2003) https://doi.org/10.1016/S0003-2670(03)00094-1
  14. D. Yoon, M. Lee, S. Kim, and S. Kim, J. Kor. Magn. Reson. Soc. 17, 1 (2013)
  15. H.-E. Kim, Y. H. Choi, K.-H. Choi, J. S. Park, H. S. Kim, J. H. Jeon, M. S. Heu, D.-S. Shin, and J.-H. Lee, J. Kor. Magn. Reson. Soc. 16, 91 (2012)
  16. S.-J. Hur, H.-W. Lee, A.-H. Shin, and S. J. Park, J. Kor. Magn. Reson. Soc. 18, 10 (2014) https://doi.org/10.6564/JKMRS.2014.18.1.010
  17. D. Yoon, J. Choi, H. Choi, and S. Kim, J. Kor. Magn. Reson. Soc. 20, 13 (2016) https://doi.org/10.6564/JKMRS.2016.20.1.013
  18. K. Choi, J. S. Park, H. S. Kim, Y. H. Choi, J. H. Jeon, and J. Lee, J. Kor. Magn. Reson. Soc. 21, 119 (2017)
  19. Y.-S. Jung, J. Kor. Magn. Reson. Soc. 21, 96 (2017) https://doi.org/10.6564/JKMRS.2017.21.3.096
  20. Y.-S. Jung, J. Kor. Magn. Reson. Soc. 22, 10 (2018)