Prof Royston Goodacre

(Former)

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Publications

  1. Article › Research › Peer-reviewed
  2. Published

    1H NMR, GC-EI-TOFMS, and data set correlation for fruit metabolomics: Application to spatial metabolite analysis in melon

    Biais, B., Allwood, J. W., Deborde, C., Xu, Y., Maucourt, M., Beauvoit, B., Dunn, W. B., Jacob, D., Goodacre, R., Rolin, D. & Moing, A., 15 Apr 2009, In : Analytical Chemistry. 81, 8, p. 2884-2894 10 p.

    Research output: Contribution to journalArticle

  3. Published

    2p or not 2p: tuppence-based SERS for the detection of illicit materials.

    Mabbott, S., Eckmann, A., Casiraghi, C. & Goodacre, R., 7 Jan 2013, In : Analyst. 138, 1, p. 118-122 4 p.

    Research output: Contribution to journalArticle

  4. Published

    A comparative investigation of modern feature selection and classification approaches for the analysis of mass spectrometry data

    Gromski, P. S., Xu, Y., Correa, E., Ellis, D. I., Turner, M. L. & Goodacre, R., 4 Jun 2014, In : Analytica Chimica Acta. 829, p. 1-8 8 p.

    Research output: Contribution to journalArticle

  5. Published

    A comparison of different chemometrics approaches for the robust classification of electronic nose data.

    Gromski, P. S., Correa, E., Vaughan, A. A., Wedge, D. C., Turner, M. L. & Goodacre, R., 2014, In : Analytical and bioanalytical chemistry. 406, 29, p. 7581-7590 10 p.

    Research output: Contribution to journalArticle

  6. Published

    A flavour of omics approaches for the detection of food fraud

    Ellis, D., Muhamad Ali, H., Allen, D., Elliott, C. T. & Goodacre, R., Aug 2016, In : Current Opinion in Food Science. 10, p. 7-15 9 p.

    Research output: Contribution to journalArticle

  7. Published
  8. Published

    A laser desorption ionisation mass spectrometry approach for high throughput metabolomics

    Vaidyanathan, S., Jones, D., Broadhurst, D. I., Ellis, J., Jenkins, T., Dunn, W. B., Hayes, A., Burton, N., Oliver, S. G., Kell, D. B. & Goodacre, R., Jul 2005, In : Metabolomics. 1, 3, p. 243-250 7 p.

    Research output: Contribution to journalArticle

  9. Published

    A metabolome pipeline: from concept to data to knowledge

    Brown, M., Dunn, W. B., Ellis, D. I., Goodacre, R., Handl, J., Knowles, J. D., O'Hagan, S., Spasic, I. & Kell, D. B., Mar 2005, In : Metabolomics. 1, 1, p. 39-51 13 p.

    Research output: Contribution to journalArticle

  10. Published

    A metabolomics investigation into the effects of HIV protease inhibitors on HPV16 E6 expressing cervical carcinoma cells.

    Kim, D. H., Allwood, J. W., Moore, R. E., Marsden-Edwards, E., Dunn, W. B., Xu, Y., Hampson, L., Hampson, I. & Goodacre, R., 4 Mar 2014, In : Molecular BioSystems. 10, 3, p. 398-411 13 p.

    Research output: Contribution to journalArticle

  11. Published

    A Novel Adaptation Mechanism Underpinning Algal Colonization of a Nuclear Fuel Storage Pond

    MeGraw, V. E., Brown, A. R., Boothman, C., Goodacre, R., Morris, K., Sigee, D., Anderson, L. & Lloyd, J., 26 Jun 2018, In : mBio. 9, 3

    Research output: Contribution to journalArticle

  12. Published

    A novel untargeted metabolomics correlation-based network analysis incorporating human metabolic reconstructions

    Kotze, H. L., Armitage, E. G., Sharkey, K. J., Allwood, J. W., Dunn, W. B., Williams, K. J. & Goodacre, R., 23 Oct 2013, In : BMC Systems Biology. 7, 107.

    Research output: Contribution to journalArticle

  13. Published

    A proposed framework for the description of plant metabolomics experiments and their results

    Jenkins, H., Hardy, N., Beckmann, M., Draper, J., Smith, A. R., Taylor, J., Fiehn, O., Goodacre, R., Bino, R. J., Hall, R., Kopka, J., Lane, G. A., Lange, B. M., Liu, J. R., Mendes, P., Nikolau, B. J., Oliver, S. G., Paton, N. W., Rhee, S., Roessner-Tunali, U. & 7 othersSaito, K., Smedsgaard, J., Sumner, L. W., Wang, T., Walsh, S., Wurtele, E. S. & Kell, D. B., Dec 2004, In : Nature biotechnology. 22, 12, p. 1601-1606 5 p.

    Research output: Contribution to journalArticle

  14. Published

    A tutorial review: Metabolomics and partial least squares-discriminant analysis - a marriage of convenience or a shotgun wedding

    Gromski, P. S., Muhamadali, H., Ellis, D. I., Xu, Y., Correa, E., Turner, M. L. & Goodacre, R., 16 Jun 2015, In : Analytica Chimica Acta. 879, p. 10-23 14 p.

    Research output: Contribution to journalArticle

  15. Published

    Absolute quantification of uric acid in human urine using surface enhanced Raman scattering with the standard addition method

    Westley, C., Xu, Y., Thilaganathan, B., Carnell, A. J., Turner, N. & Goodacre, R., 21 Feb 2017, In : Analytical Chemistry. 89, 4, p. 2472–2477 6 p.

    Research output: Contribution to journalArticle

  16. Published

    Acclimation of metabolism to light in Arabidopsis thaliana: the glucose 6-phosphate/phosphate translocator GPT2 directs metabolic acclimation

    Dyson, B. C., Allwood, J. W., Feil, R., Xu, Y., Miller, M., Bowsher, C. G., Goodacre, R., Lunn, J. E., Johnson, G. N. & Yun, X., 2015, In : Plant Cell and Environment. 38, 7, p. 1404-1417 14 p.

    Research output: Contribution to journalArticle

  17. Published

    Accumulation of ionic liquids in Escherichia coli cells

    Cornmell, R. J., Winder, C. L., Tiddy, G. J. T., Goodacre, R. & Stephens, G., 2008, In : Green Chemistry. 10, 8, p. 836-841 5 p.

    Research output: Contribution to journalArticle

  18. Published

    Achieving optimal SERS through enhanced experimental design

    Turner, N., Fisk, H., Westley, C. & Goodacre, R., 16 Dec 2016, In : Journal of Raman Spectroscopy. 47, 1, p. 59-66

    Research output: Contribution to journalArticle

  19. Published

    An automated Design-Build-Test-Learn pipeline for enhanced microbial production of fine chemicals

    Carbonell, P., Jervis, A., Robinson, C., Yan, C., Dunstan, M., Swainston, N., Vinaixa, M., Hollywood, K., Currin, A., Rattray, N., Taylor, S., Spiess, R., Sung, R., Williams, A. R., Fellows, D., Stanford, N., Mulherin, P., Le Feuvre, R., Barran, P., Goodacre, R. & 9 othersTurner, N., Goble, C., Guoqiang Chen, G., Kell, D., Micklefield, J., Breitling, R., Takano, E., Faulon, J-L. & Scrutton, N., 2018, In : Communications Biology. 1, 66.

    Research output: Contribution to journalArticle

  20. Published

    An improved fluorescemt amplified fragment length polymorphism method for typing Mycobacterium tuberculosis [2]

    Kassama, Y., Shemko, M., Shetty, N., Fang, Z., MacIntire, G., Gant, V., Zumla, A. & Goodacre, R., Jan 2006, In : Journal of clinical microbiology. 44, 1, p. 288-289 1 p.

    Research output: Contribution to journalArticle

  21. Published

    An introduction to liquid chromatography-mass spectrometry instrumentation applied in plant metabolomic analyses

    Allwood, J. W. & Goodacre, R., 2010, In : Phytochemical Analysis. 21, 1, p. 33-47 14 p.

    Research output: Contribution to journalArticle

  22. Published

    Application of high-throughput Fourier-transform infrared spectroscopy in toxicology studies: Contribution to a study on the development of an animal model for idiosyncratic toxicity

    Harrigan, G. G., LaPlante, R. H., Cosma, G. N., Cockerell, G., Goodacre, R., Maddox, J. F., Luyendyk, J. P., Ganey, P. E. & Roth, R. A., 2 Feb 2004, In : Toxicology Letters. 146, 3, p. 197-205 8 p.

    Research output: Contribution to journalArticle

  23. Published

    Application of surface enhanced Raman scattering to the solution based detection of a popular legal high, 5,6-methylenedioxy-2-aminoindane (MDAI)

    Mabbott, S., Alharbi, O., Groves, K. & Goodacre, R., 7 Jul 2015, In : Analyst. 140, 13, p. 4399-4406 8 p.

    Research output: Contribution to journalArticle

  24. Published

    Applying metabolic fingerprinting to ecology: The use of Fourier-transform infrared spectroscopy for the rapid screening of plant responses to N deposition

    Gidman, E., Goodacre, R., Emmett, B., Sheppard, L. J., Leith, I. D. & Gwynn-Jones, D., Dec 2004, In : Water, Air, and Soil Pollution: Focus. 4, 6, p. 251-258 7 p.

    Research output: Contribution to journalArticle

  25. Published

    Aseptic Raman spectroscopy can detect changes associated with the culture of human dental pulp stromal cells in osteoinductive culture

    Mitchell, A., Ashton, L., Yang, X. B., Goodacre, R., Tomlinson, M. J., Smith, A. & Kirkham, J., 7 Nov 2015, In : Analyst. 140, 21, p. 7347-7354 8 p.

    Research output: Contribution to journalArticle

  26. Published
  27. Published

    ATR (ataxia telangiectasia mutated- and Rad3-related kinase) is activated by mild hypothermia in mammalian cells and subsequently activates p53

    Roobol, A., Roobol, J., Carden, M. J., Bastide, A., Willis, A. E., Dunn, W. B., Goodacre, R. & Smales, C. M., 15 Apr 2011, In : Biochemical Journal. 435, 2, p. 499-508 9 p.

    Research output: Contribution to journalArticle

  28. Published

    Automated workflows for accurate mass-based putative metabolite identification in LC/MS-derived metabolomic datasets

    Mamas, M., Brown, M., Wedge, D. C., Goodacre, R., Kell, D. B., Baker, P. N., Kenny, L. C., Mamas, M. A., Neyses, L. & Dunn, W. B., Apr 2011, In : Bioinformatics. 27, 8, p. 1108-1112 4 p., btr079.

    Research output: Contribution to journalArticle

  29. Published

    Biochemical analyses of sorghum varieties reveal differential responses to drought

    Ogbaga, C., Stepien, P., Dyson, B., Rattray, N., Ellis, D., Goodacre, R. & Johnson, G., 6 May 2016, In : PLoS ONE. 11, 5, e015442.

    Research output: Contribution to journalArticle

  30. Published

    Biochemical signatures of acclimation by Chlamydomonas reinhardtii to different ionic stresses

    Charles, E. D., Muhamadali, H., Goodacre, R. & Pittman, J., Jan 2019, In : Algal Research. 37, p. 83-91 8 p.

    Research output: Contribution to journalArticle

  31. Published

    Biofluids and other techniques: General discussion

    Goodacre, R., Baker, M. J., Graham, D., Schultz, Z. D., Diem, M., Marques, M. P., Cinque, G., Vernooij, R., Sulé-Suso, J., Byrne, H. J., Faulds, K., Hermes, M., Fleming, H., Bonifacio, A., Dluhy, R., Gardner, P., El-Mashtoly, S., Wood, B., Gough, K., Fornasaro, S. & 15 othersKazarian, S., Jamieson, L., Petrich, W., Sockalingum, G. D., Stone, N., Kendall, C., Sinjab, F., Haris, P., Subaihi, A., Remiszewski, S., Hellwig, P., Sergo, V., Gerwert, K., Phillips, C. & Campbell, C. J., 2016, In : Faraday Discussions. 187, p. 575-601 27 p.

    Research output: Contribution to journalArticle

  32. Published

    Biomarkers of dietary energy restriction in women at increased risk of breast cancer

    Ong, K. R., Sims, A. H., Harvie, M., Chapman, M., Dunn, W. B., Broadhurst, D., Goodacre, R., Wilson, M., Thomas, N., Clarke, R. B. & Howell, A., Aug 2009, In : Cancer Prevention Research. 2, 8, p. 720-731 11 p.

    Research output: Contribution to journalArticle

  33. Published

    Characterisation and identification of bacteria using SERS

    Jarvis, R. M. & Goodacre, R., 2008, In : Chemical Society Reviews. 37, 5, p. 931-936 5 p.

    Research output: Contribution to journalArticle

  34. Published

    Characterization of Microorganisms Using UV Resonance Raman Spectroscopy and Chemometrics

    López-Díez, E. C. & Goodacre, R., 1 Feb 2004, In : Analytical Chemistry. 76, 3, p. 585-591 6 p.

    Research output: Contribution to journalArticle

  35. Published

    Chemometric discrimination of unfractionated plant extracts analyzed by electrospray mass spectrometry

    Goodacre, R., York, E. V., Heald, J. K. & Scott, I. M., Mar 2003, In : Phytochemistry. 62, 6, p. 859-863 4 p.

    Research output: Contribution to journalArticle

  36. Published
  37. Published

    Chicken, beams, and Campylobacter: rapid differentiation of foodborne bacteria via vibrational spectroscopy and MALDI-mass spectrometry. rapid differentiation of foodborne bacteria via vibrational spectroscopy and MALDI-mass spectrometry

    Muhamadali, H., Weaver, D., Subaihi, A., AlMasoud, N., Trivedi, D. K., Ellis, D. I., Linton, D. & Goodacre, R., 14 Dec 2016, In : The Analyst. 141, 1, p. 111-122 12 p.

    Research output: Contribution to journalArticle

  38. Accepted/In press

    CIRCADIAN RHYTHM OF EXHALED BIOMARKERS IN HEALTH AND ASTHMA

    Wilkinson, M., Maidstone, R., Loudon, A., Blaikley, J., White, I., Singh, D., Ray, D., Goodacre, R., Fowler, S. & Durrington, H., 5 Jun 2019, (Accepted/In press) In : The European respiratory journal.

    Research output: Contribution to journalArticle

  39. Published

    Classification of Bacillus and Brevibacillus species using rapid analysis of lipids by mass spectrometry

    AlMasoud, N., Xu, Y., Trivedi, D., Salivo, S., Abban, T., Rattray, N., Szula, E., Alrabiah, H., Sayqal, A. & Goodacre, R., Nov 2016, In : Analytical and bioanalytical chemistry. 408, 27

    Research output: Contribution to journalArticle

  40. Published

    Clinical Applications of Infrared and Raman Spectroscopy: State of Play and Future Challenges

    Baker, M. J., Byrne, H. J., Chalmers, J., Gardner, P., Goodacre, R., Henderson, A., Kazarian, S., Martin, F. L., Moger, J., Stone, N. & Sulé-Suso, J., 2018, In : Analyst. 8

    Research output: Contribution to journalArticle

  41. Published

    Clinical Spectroscopy: General discussion

    Goodacre, R., Sergo, V., Barr, H., Sammon, C., Schultz, Z. D., Baker, M. J., Graham, D., Marques, M. P., Sulé-Suso, J., Livermore, J., Faulds, K., Sinjab, F., Matousek, P., Campbell, C. J., Dluhy, R., Gardner, P., Phillips, C., Diem, M., Wood, B., Apolonskiy, A. & 21 othersKazarian, S., Fullwood, L., Gough, K., Petrich, W., Lloyd, G., Ibrahim, O., Cinque, G., Sockalingum, G. D., Stone, N., Kendall, C., McAughtrie, S., Perez-Guaita, D., Clark, L., Gerwert, K., Bonifacio, A., Notingher, I., Lasch, P., Bhargava, R., Lepert, G., Mader, K. & Paterson, C., 2016, In : Faraday Discussions. 187, p. 429-460 32 p.

    Research output: Contribution to journalArticle

  42. Published

    Combining metabolic fingerprinting and footprinting to understand the phenotypic response of HPV16 E6 expressing cervical carcinoma cells exposed to the HIV anti-viral drug lopinavir

    Kim, D. H., Jarvis, R. M., Xu, Y., Oliver, A. W., Allwood, J. W., Hampson, L., Hampson, I. N. & Goodacre, R., Jun 2010, In : Analyst. 135, 6, p. 1235-1244 9 p.

    Research output: Contribution to journalArticle

  43. Published

    Combining Raman and FT-IR spectroscopy with quantitative isotopic labelling for differentiation of E. coli cells at community and single cell levels

    Muhamadali, H., Chisanga, M., Subaihi, A. & Goodacre, R., 2015, In : Analytical Chemistry.

    Research output: Contribution to journalArticle

  44. Published
  45. Published
  46. Published

    Comparison of diffuse-reflectance absorbance and attenuated total reflectance FT-IR for the discrimination of bacteria

    Winder, C. L. & Goodacre, R., Nov 2004, In : Analyst. 129, 11, p. 1118-1122 4 p.

    Research output: Contribution to journalArticle

  47. Published

    Comparison of five xylan synthesis mutants reveals new insight into the mechanisms of xylan synthesis

    Brown, D. M., Goubet, F., Wong, V. W., Goodacre, R., Stephens, E., Dupree, P. & Turner, S. R., Dec 2007, In : Plant Journal. 52, 6, p. 1154-1168 14 p.

    Research output: Contribution to journalArticle

  48. Published

    Computational tools and workflows in metabolomics: An international survey highlights the opportunity for harmonisation through Galaxy

    Weber, R. J. M., Lawson, T., Salek, R. M., Ebbels, T., Robert, G., Goodacre, R., Griffin, J. L., Haug, K., Koulman, A., Moreno, P., Ralser, M., Steinbeck, C., Dunn, W. B. & Viant, M. R., Feb 2017, In : Metabolomics. 13, 12

    Research output: Contribution to journalArticle

  49. Published

    Continued growth, continual progress, and continuous publications

    Goodacre, R., 1 Feb 2016, In : Metabolomics. 12, 2, p. 1-2 2 p., 17.

    Research output: Contribution to journalArticle

  50. Published

    Contribution of pyrolysis-mass spectrometry (Py-MS) to authenticity testing of honey

    Radovic, B. S., Goodacre, R. & Anklam, E., Jun 2001, In : Journal of Analytical and Applied Pyrolysis. 60, 1, p. 79-87 8 p.

    Research output: Contribution to journalArticle

  51. Published

    COordination of Standards in MetabOlomicS (COSMOS): facilitating integrated metabolomics data access

    Salek, R. M., Neumann, S., Schober, D., Hummel, J., Billiau, K., Kopka, J., Correa, E., Reijmers, T., Rosato, A., Tenori, L., Turano, P., Marin, S., Deborde, C., Jacob, D., Rolin, D., Dartigues, B., Conesa, P., Haug, K., Rocca-Serra, P., O’Hagan, S. & 19 othersHao, J., van Vliet, M., Sysi-Aho, M., Ludwig, C., Bouwman, J., Cascante, M., Ebbels, T., Griffin, J. L., Moing, A., Nikolski, M., Oresic, M., Sansone, S. A., Viant, M. R., Goodacre, R., Günther, U. L., Hankemeier, T., Luchinat, C., Walther, D. & Steinbeck, C., 26 May 2015, In : Metabolomics. 11, 6, p. 1587-1597 11 p.

    Research output: Contribution to journalArticle

  52. Published

    Data standards can boost metabolomics research, and if there is a will, there is a way

    Rocca-Serra, P., Salek, R. M., Arita, M., Correa, E., Dayalan, S., Gonzalez-Beltran, A., Ebbels, T., Goodacre, R., Hastings, J., Haug, K., Koulman, A., Nikolski, M., Oresic, M., Sansone, S. A., Schober, D., Smith, J., Steinbeck, C., Viant, M. R. & Neumann, S., 1 Jan 2016, In : Metabolomics. 12, 1, p. 1-13 13 p., 14.

    Research output: Contribution to journalArticle

  53. Published

    Degeneration of solventogenic Clostridium strains monitored by Fourier transform infrared spectroscopy of bacterial cells

    Schuster, K. C., Goodacre, R., Gapes, J. R. & Young, M., 2001, In : Journal of Industrial Microbiology and Biotechnology. 27, 5, p. 314-321 7 p.

    Research output: Contribution to journalArticle

  54. Published

    Detecting food authenticity and integrity

    Ellis, D. I. & Goodacre, R., 28 Apr 2016, In : Analytical Methods. 8, 16, p. 3281-3283 3 p.

    Research output: Contribution to journalArticle

  55. Published

    Detection and quantification of bacterial spoilage in milk and pork meat using MALDI-TOF-MS and multivariate analysis

    Nicolaou, N., Xu, Y. & Goodacre, R., 17 Jul 2012, In : Analytical Chemistry. 84, 14, p. 5951-5958 7 p.

    Research output: Contribution to journalArticle

  56. Published

    Detection and quantification of the opioid tramadol in urine using surface enhanced Raman scattering

    Alharbi, O., Xu, Y. & Goodacre, R., 7 Sep 2015, In : Analyst. 140, 17, p. 5965-5970 6 p.

    Research output: Contribution to journalArticle

  57. Published

    Detection of early stage changes associated with adipogenesis using Raman spectroscopy under aseptic conditions

    Mitchell, A., Ashton, L., Yang, X. B., Goodacre, R., Smith, A. & Kirkham, J., 1 Nov 2015, In : Cytometry Part A. 87, 11, p. 1012-1019 8 p.

    Research output: Contribution to journalArticle

  58. Published

    Detection of glycosylation and iron-binding protein modifications using Raman spectroscopy

    Ashton, L., Brewster, V. L., Correa, E. & Goodacre, R., 7 Mar 2017, In : Analyst. 142, 5, p. 808-814 7 p.

    Research output: Contribution to journalArticle

  59. Published

    Detection of protein glycosylation using tip enhanced Raman scattering

    Cowcher, D. P., Deckert-Gaudig, T., Brewster, V. L., Ashton, L., Deckert, V. & Goodacre, R., 2016, In : Analytical Chemistry. 88, 4, p. 2105–2112

    Research output: Contribution to journalArticle

  60. Published

    Development and performance of a gas chromatography-time-of-flight mass spectrometry analysis for large-scale nontargeted metabolomic studies of human serum

    Begley, P., Francis-McIntyre, S., Dunn, W. B., Broadhurst, D. I., Halsall, A., Tseng, A., Knowles, J., Goodacre, R., Kell, D. B. & HUSERMET Consortium, 15 Aug 2009, In : Analytical Chemistry. 81, 16, p. 7038-46 9 p.

    Research output: Contribution to journalArticle

  61. Published

    Development of an adaptable headspace sampling method for metabolic profiling of the fungal volatome

    Ahmed, W. M., Geranios, P., White, I. R., Bromley, M., Lawal, O., Nijsen, T., Goodacre, R., Read, N. & Fowler, S. J., 2018, In : The Analyst.

    Research output: Contribution to journalArticle

  62. Published
  63. Published

    Differentiation of peats used in the preparation of malt for scotch whisky production using fourier transform infrared spectroscopy

    Harrison, B., Ellis, J., Broadhurst, D., Reid, K., Goodacre, R. & Priest, F. G., 2006, In : Journal of the Institute of Brewing. 112, 4, p. 333-339 6 p.

    Research output: Contribution to journalArticle

  64. Published

    Direct infusion electrospray ionization mass spectra of crude cell extracts for microbial characterizations: Influence of solvent conditions on the detection of proteins

    Vaidyanathan, S., O'Hagan, S. & Goodacre, R., 2006, In : Rapid communications in mass spectrometry : RCM. 20, 1, p. 21-30 9 p.

    Research output: Contribution to journalArticle

  65. Published

    Discrimination of aerobic endospore-forming bacteria via electrospray-ionization mass spectrometry of whole cell suspensions

    Vaidyanathan, S., Rowland, J. J., Kell, D. B. & Goodacre, R., 1 Sep 2001, In : Analytical Chemistry. 73, 17, p. 4134-4144 10 p.

    Research output: Contribution to journalArticle

  66. Published

    Discrimination of bacteria using pyrolysis-gas chromatography-differential mobility spectrometry (Py-GC-DMS) and chemometrics

    Cheung, W., Xu, Y., Thomas, C. L. P. & Goodacre, R., 2009, In : Analyst. 134, 3, p. 557-563 6 p.

    Research output: Contribution to journalArticle

  67. Published

    Discrimination of Bacteria Using Surface-Enhanced Raman Spectroscopy

    Jarvis, R. M. & Goodacre, R., 1 Jan 2004, In : Analytical Chemistry. 76, 1, p. 40-47 7 p.

    Research output: Contribution to journalArticle

  68. Published

    Dissecting the mechanisms of environmental stress adaptation: A systems biology approach

    Cossins, A., Hayward, S., Gossage, S. & Goodacre, R., 2008, In : Comparative Biochemistry and Physiology Part a Molecular and Integrative Physiology. 150, p. S43-S43

    Research output: Contribution to journalArticle

  69. Published

    Dual metabolomics: A novel approach to understanding plant-pathogen interactions

    William Allwood, J., Clarke, A., Goodacre, R. & Mur, L. A. J., Apr 2010, In : Phytochemistry. 71, 5-6, p. 590-597 7 p.

    Research output: Contribution to journalArticle

  70. Published

    Dupuytren's Disease metabolite analyses reveals alterations following initial short-term fibroblast culturing

    Rehman, S., Xu, Y., Dunn, W. B., Day, P. J. R., Westerhoff, H. V., Goodacre, R. & Bayat, A., Sep 2012, In : Molecular BioSystems. 8, 9, p. 2274-2288 14 p.

    Research output: Contribution to journalArticle

  71. Published

    Dupuytren's: A systems biology disease

    Rehman, S., Goodacre, R., Day, P. J., Bayat, A. & Westerhoff, H. V., 12 Sep 2011, In : Arthritis Res Ther. 13, 5, 238.

    Research output: Contribution to journalArticle

  72. Published

    Effective quenching processes for physiologically valid metabolite profiling of suspension cultured mammalian cells

    Sellick, C. A., Hansen, R., Maqsood, A. R., Dunn, W. B., Stephens, G. M., Goodacre, R. & Dickson, A. J., 1 Jan 2009, In : Analytical Chemistry. 81, 1, p. 174-183 9 p.

    Research output: Contribution to journalArticle

  73. Published

    Electrochemical modulation of SERS at the liquid/liquid interface

    Booth, S. G., Cowcher, D. P., Goodacre, R. & Dryfe, R. A. W., 4 May 2014, In : Chemical Communications. 50, 34, p. 4482-4484 3 p.

    Research output: Contribution to journalArticle

  74. Published

    Electronic cigarette exposure triggers neutrophil inflammatory responses

    Higham, A., Rattray, N. J. W., Dewhurst, J. A., Trivedi, D. K., Fowler, S. J., Goodacre, R. & Singh, D., 17 May 2016, In : Respiratory research. 17, 1, p. 56 56.

    Research output: Contribution to journalArticle

  75. Published

    Elevated luteinizing hormone despite normal testosterone levels in older men—natural history, risk factors and clinical features

    Eendebak, R. J. A. H., Ahern, T., Swiecicka, A., Pye, S. R., O'Neill, T., Bartfai, G., Forti, G., Giwercman, A., Han, T. S., Slowikowska-Hilczer, J., Lean, M., Maggi, M., Punab, M., Pendleton, N., Keevil, B., Vanderschueren, D., Rutter, M., Tampubolon, G., Goodacre, R., Huhtaniemi, I. T. & 2 othersWu, F. C. W. & EMAS Group, 2018, In : Clinical Endocrinology. 88, 3, p. 479-490

    Research output: Contribution to journalArticle

  76. Published

    Enhancing surface enhanced Raman scattering (SERS) detection of propranolol with multiobjective evolutionary optimization

    Levene, C., Correa, E., Blanch, E. W. & Goodacre, R., 18 Sep 2012, In : Analytical Chemistry. 84, 18, p. 7899-7905 6 p.

    Research output: Contribution to journalArticle

  77. Published

    Ethnic differences in male reproductive hormones and relationships with adiposity and insulin resistance in older men

    Eendebak, R. J. A. H., Swiecicka, A., Gromski, P. S., Pye, S. R., O'Neill, T. W., Marshall, A., Keevil, B. G., Tampubolon, G., Goodacre, R., Wu, F. C. W. & Rutter, M. K., May 2017, In : Clinical Endocrinology. 86, 5, p. 660-668

    Research output: Contribution to journalArticle

  78. Published

    Evaluation of extraction processes for intracellular metabolite profiling of mammalian cells: Matching extraction approaches to cell type and metabolite targets

    Sellick, C. A., Knight, D., Croxford, A. S., Maqsood, A. R., Stephens, G. M., Goodacre, R. & Dickson, A. J., 2010, In : Metabolomics. 6, 3, p. 427-438 11 p.

    Research output: Contribution to journalArticle

  79. Published

    Evaluation of metabolomics profiles of grain from maize hybrids derived from near-isogenic GM positive and negative segregant inbreds demonstrates that observed differences cannot be attributed unequivocally to the GM trait

    Harrigan, G. G., Venkatesh, T. V., Leibman, M., Blankenship, J., Perez, T., Halls, S., Chassy, A. W., Fiehn, O., Xu, Y. & Goodacre, R., 1 May 2016, In : Metabolomics. 12, 5, 14 p., 82.

    Research output: Contribution to journalArticle

  80. Published

    Evidence That Multiple Defects in Lipid Regulation Occur before Hyperglycemia during the Prodrome of Type-2 Diabetes

    Anderson, S. G., Dunn, W., Banerjee, M., Brown, M., Broadhurst, D. I., Goodacre, R., Cooper, G. J. S., Kell, D. B. & Cruickshank, J. K., 3 Sep 2014, In : PLoS ONE. 9, 9, e103217.

    Research output: Contribution to journalArticle

  81. Published

    Exhaled breath metabolomics reveals a pathogen-specific response in a rat pneumonia model for two human pathogenic bacteria: a proof-of-concept study

    van Oort, P. M. P., Brinkman, P., Slingers, G., Koppen, G., Maas, A., Roelofs, J. J. T. H., Schnabel, R., Bergmans, D. C., Raes, M., Goodacre, R., Fowler, S. J., Schultz, M. J., Bos, L. D. & BreathDx Consortium, 2019, In : American journal of physiology. Lung cellular and molecular physiology.

    Research output: Contribution to journalArticle

  82. Published

    Exhaled Volatile Organic Compounds of Infection: A Systematic Review

    Ahmed, W. M., Lawal, O., Nijsen, T. M., Goodacre, R. & Fowler, S. J., 13 Oct 2017, In : ACS Infectious Diseases. 3, 10, p. 695-710 16 p.

    Research output: Contribution to journalArticle

  83. Published

    Explanatory analysis of spectroscopic data using machine learning of simple, interpretable rules

    Goodacre, R., 5 Aug 2003, In : Vibrational Spectroscopy. 32, 1, p. 33-45 12 p.

    Research output: Contribution to journalArticle

  84. Published

    Explanatory multivariate analysis of ToF-SIMS spectra for the discrimination of bacterial isolates

    Vaidyanathan, S., Fletcher, J. S., Jarvis, R. M., Henderson, A., Lockyer, N. P., Goodacre, R. & Vickerman, J. C., 2009, In : Analyst. 134, 11, p. 2352-2360 8 p.

    Research output: Contribution to journalArticle

  85. Published

    Explanatory Optimization of Protein Mass Spectrometry via Genetic Search

    Vaidyanathan, S., Broadhurst, D. I., Kell, D. B. & Goodacre, R., 1 Dec 2003, In : Analytical Chemistry. 75, 23, p. 6679-6686 7 p.

    Research output: Contribution to journalArticle

  86. Published

    Exploring the mode of action of dithranol therapy for psoriasis: a metabolomic analysis using HaCaT cells.

    Hollywood, K. A., Winder, C. L., Dunn, W. B., Xu, Y., Broadhurst, D., Griffiths, C. E. M. & Goodacre, R., Aug 2015, In : Molecular BioSystems. 11, 8

    Research output: Contribution to journalArticle

  87. Published

    Extensive metabolic cross-talk in melon fruit revealed by spatial and developmental combinatorial metabolomics

    Moing, A., Aharoni, A., Biais, B., Rogachev, I., Meir, S., Brodsky, L., Allwood, J. W., Erban, A., Dunn, W. B., Kay, L., de Koning, S., de Vos, R. C. H., Jonker, H., Mumm, R., Deborde, C., Maucourt, M., Bernillon, S., Gibon, Y., Hansen, T. H., Husted, S. & 5 othersGoodacre, R., Kopka, J., Schjoerring, J. K., Rolin, D. & Hall, R. D., May 2011, In : New Phytologist. 190, 3, p. 683-696 13 p.

    Research output: Contribution to journalArticle

  88. Published

    Fingerprinting food: Current technologies for the detection of food adulteration and contamination

    Ellis, D., Brewster, V., Dunn, W., Allwood, J., Golovanov, A. & Goodacre, R., 7 Sep 2012, In : Chemical Society Reviews. 41, 17, p. 5706-5727 21 p.

    Research output: Contribution to journalArticle

  89. Published

    Flow-injection electrospray ionization mass spectrometry of crude cell extracts for high-throughput bacterial identification

    Vaidyanathan, S., Kell, D. B. & Goodacre, R., 2002, In : Journal of the American Society for Mass Spectrometry. 13, 2, p. 118-128 10 p.

    Research output: Contribution to journalArticle

  90. Published

    Fluorescent amplified fragment length polymorphism probabilistic database for identification of bacterial isolates from urinary tract infections

    Kassama, Y., Rooney, P. J. & Goodacre, R., 1 Aug 2002, In : Journal of clinical microbiology. 40, 8, p. 2795-2800 5 p.

    Research output: Contribution to journalArticle

  91. Published

    Food quality and microbial succession in ageing earthworm casts: Standard microbial indices and metabolic fingerprinting

    Scullion, J., Goodacre, R., Elliott, G., Huang, W., Worgan, H., Gwynn-Jones, D., Griffith, G., Darby, R., Bailey, M., Clegg, C. & Draper, J., 2003, In : Pedobiologia. 47, 5-6, p. 888-894 6 p.

    Research output: Contribution to journalArticle

  92. Published
  93. Published

    Fourier transform infrared spectroscopy and chemometrics as a tool for the rapid detection of other vegetable fats mixed in cocoa butter

    Goodacre, R. & Anklam, E., Oct 2001, In : JAOCS, Journal of the American Oil Chemists' Society. 78, 10, p. 993-1000 7 p.

    Research output: Contribution to journalArticle

  94. Published

    Fourier transform infrared spectroscopy and multivariate analysis for the detection and quantification of different milk species

    Nicolaou, N., Xu, Y. & Goodacre, R., Dec 2010, In : Journal of Dairy Science. 93, 12, p. 5651-5660 9 p.

    Research output: Contribution to journalArticle

  95. Published

    Fourier transform infrared spectroscopy as a metabolite fingerprinting tool for monitoring the phenotypic changes in complex bacterial communities capable of degrading phenol

    Wharfe, E. S., Jarvis, R. M., Winder, C. L., Whiteley, A. S. & Goodacre, R., Dec 2010, In : Environmental microbiology. 12, 12, p. 3253-3263 10 p.

    Research output: Contribution to journalArticle

  96. Published

    Fourier transform ion cyclotron resonance mass spectrometry for plant metabolite profiling and metabolite identification

    Allwood, J. W., Parker, D., Beckmann, M., Draper, J. & Goodacre, R., 2012, In : Methods in Molecular Biology. 860, p. 157-176 19 p.

    Research output: Contribution to journalArticle

  97. Published

    Fractional Factorial Design of MALDI-TOF-MS sample preparations for the optimized detection of phospholipids and acylglycerols

    Almasoud, N., Correa, E., Trivedi, D. & Goodacre, R., 26 May 2016, In : Analytical Chemistry. 88, 12, p. 6301–6308 8 p.

    Research output: Contribution to journalArticle

  98. Published

    From Multistep Enzyme Monitoring to Whole-Cell Biotransformations: Development of Real-Time Ultraviolet Resonance Raman Spectroscopy

    Fisk, H., Xu, Y., Westley, C., Turner, N., Micklefield, J. & Goodacre, R., 21 Nov 2017, In : Analytical Chemistry. 89, 22, p. 12527-12532 5 p.

    Research output: Contribution to journalArticle

  99. Published

    From phenotype to genotype: whole tissue profiling for plant breeding

    Goodacre, R., Roberts, L., Ellis, D. I., Thorogood, D., Reader, S. M., Ougham, H. & King, I., Dec 2007, In : Metabolomics. 3, 4, p. 489-501 13 p.

    Research output: Contribution to journalArticle

  100. Published

    FUM2, a cytosolic fumarase, is essential for acclimation to low temperature in arabidopsis thaliana

    Dyson, B. C., Miller, M. A. E., Feil, R., Rattray, N., Bowsher, C. G., Goodacre, R., Lunn, J. E. & Johnson, G. N., 20 Jul 2016, In : Plant Physiology. 172, 1, p. 118-127 10 p.

    Research output: Contribution to journalArticle

  101. Published

    Functional Exchangeability of Oxidase and Dehydrogenase Reactions in the Biosynthesis of Hydroxyphenylglycine, a Nonribosomal Peptide Building Block.

    Diez, V., Loznik, M., Taylor, S., Winn, M., Rattray, N., Podmore, H., Micklefield, J., Goodacre, R., Medema, MH., Müller, U., Bovenberg, R., Janssen, DB. & Takano, E., 2015, In : ACS Synthetic Biology. 4, p. 796-807 11 p.

    Research output: Contribution to journalArticle

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