[183]    Hansen, R., Dickson, A.J. Goodacre, R., Stephens, G.M. & Sellick, C.A. (2010) Rapid characterisation of N-linked glycans from secreted and gel-purified monoclonal antibodies using MALDI-ToF mass spectroscopy.  Biotechnology & Bioengineering, in press.

[182]    Dunn, W.B., Broadhurst, D., Atherton, H.J., Goodacre, R. and Griffin, J.L., (2010) Systems level studies of mammalian metabolomes : the roles of mass spectrometry and nuclear magnetic resonance spectroscopy. Chemical Society Reviews, in press.

[181]    Wang, H., Hollywood, K., Jarvis, R.M., Lloyd, J.R. & Goodacre, R. (2010) Phenotypic characterization of Shewanella oneidensis MR-1 under aerobic and anaerobic growth using FT-IR spectroscopy and HPLC analyses. Applied and Environmental Microbiology, in press.

[180]    Wharfe, E.S., Jarvis, R.M., Winder, C.L., Whiteley, A.S. & Goodacre, R. (2010) FT-IR spectroscopy as a metabolite fingerprinting tool for monitoring the phenotypic changes in complex bacterial communities capable of degrading phenol.  Environmental Microbiology, in press.

[179]    Sellick, C.A., Knight, D., Croxford, A.S., Maqsood, A.R., Stephens, G.M., Goodacre, R. & Dickson, A.J. (2010) Evaluation of extraction processes for intracellular metabolite profiling of mammalian cells - matching extraction approaches to cell type and metabolite targets. Metabolomics 6, 427-438.

[178]    Thomas, A.N., Riazanskaia, S., Cheung, W., Xu, Y., Goodacre, R., Thomas, C.L.P., Baguneid, M.S. & Bayat, A. (2010) Novel non invasive identification of biomarkers by analytical profiling of chronic wounds using volatile organic compounds.  Wound Repair and Regeneration 18, 391-400.

[177]    Xu, Y., Cheung, W., Winder, C.L. & Goodacre, R. (2010) VOC-based metabolic profiling for food spoilage detection with the application to detecting Salmonella typhimurium contaminated pork. Analytical and Bioanalytical Chemistry 397, 2439-2449.

[176]    Jarvis, R.M., Rowe, W., Yaffe, N.R., O'Connor, R., Knowles, J.D., Blanch, E.W. & Goodacre, R. (2010) Multiobjective evolutionary optimisation for surface enhanced Raman scattering.  Analytical and Bioanalytical Chemistry 397, 1893-1901.

[175]    Kim, D.-H., Jarvis, R.M., Xu, Y., Oliver, A.W., Allwood, J.W., Hampson, L., Hampson, I.N. & Goodacre, R. (2010) 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.  Analyst 135, 1235-1244

[174]    Sellick, C.A., Hansen, R., Jarvis, R.M., Maqsood, A.R., Stephens, G.M., Dickson, A.J. & Goodacre, R. (2010) Rapid monitoring of recombinant antibody production by mammalian cell cultures using Fourier transform infrared spectroscopy and chemometrics.  Biotechnology & Bioengineering 106, 432-442.

[173]    Kassama, Y., Xu, Y., Dunn, W.B., Geukens, N., Anné, J. & Goodacre, R. (2010) Assessment of adaptive focused acoustics versus manual vortex/freeze-thaw for intracellular metabolite extraction from Streptomyces lividans producing recombinant proteins using GC-MS and multi-block principal component analysis.  Analyst 135, 934-942.

[172]    Hollywood, K.A., Shadi, I.T. & Goodacre, R. (2010) Monitoring the succinate dehydrogenase activity isolated from mitochondria by surface enhanced Raman scattering. The Journal of Physical Chemistry C 114, 7308-7313.

[171]    Cheung, W., Shadi, I.T., Xu, Y. & Goodacre, R. (2010) Quantitative analysis of the banned food dye Sudan-1 using surface enhanced Raman scattering with multivariate chemometrics.  The Journal of Physical Chemistry C 114, 7285-7290.

[170]    Allwood, J.W., Clarke, A., Goodacre, R. & Mur, L.A.J. (2010) Dual metabolomics: A novel approach to understanding plant-pathogen interactions. Phytochemistry 71, 590-597.

[169]    Wharfe, E.S., Winder, C.L., Jarvis, R.M., & Goodacre, R. (2010) Monitoring the effect of chiral pharmaceuticals on aquatic microorganisms by metabolic fingerprinting. Applied and Environmental Microbiology 76, 2075-2085.

[168]    Biais, B., Beauvoit, B., Allwood, J.W., Deborde, C., Maucourt, M., Goodacre, R., Rolin, D. & Moing, A. (2010) Metabolic acclimation to hypoxia revealed by metabolite gradients in melon fruit. Journal of Plant Physiology 167, 242-245.

[167]    Wang, H., Law, N., Pearson, G., van Dongen, B.E., Jarvis, R.M., Goodacre, R. & Lloyd, J.R. (2010) The impact of silver(I) on metabolism of Shewanella oneidensis.  Journal of Bacteriology 192, 1143-1150.

[166]    Huang, W.E., Li, M., Jarvis, R., Goodacre, R. & Banwart, S.A. (2010) Shining light on the microbial world: the application of Raman microspectroscopy. Advances in Applied Microbiology 70, 153-186.

[165]    Basanta, M., Jarvis, R.M., Xu, Y., Blackburn, G., Tal-Singer, R., Woodcock, A., Singh, D., Goodacre, R., Thomas, C.L.P. & Fowler, S.J. (2010) Non-invasive metabolomic analysis of breath using differential mobility spectrometry in patients with chronic obstructive pulmonary disease and healthy smokers.  Analyst 135, 315-320.

[164]    Allwood, J.W. & Goodacre, R. (2010) An introduction to liquid chromatography-mass spectrometry instrumentation applied in plant metabolomic analyses. Phytochemical Analysis 21, 33-47.

[163]    Allwood, J.W., Erban, A., de Koning, S., Dunn, W.B., Luedemann, A., Lommen, A., Kay, L., Löscher, R., Kopka, J. & Goodacre, R. (2009) Inter-laboratory reproducibility of gas chromatography-electron impact- time of flight mass spectrometry (GC-EI-TOFMS) based plant metabolomics.  Metabolomics 5, 479-496.

[162]    Sellick, C., Maqsood, A., Croxford, A.S., Dickson, A., Goodacre, R. & Stephens, G. (2009) Optimizing CHO cell culture conditions. Genetic Engineering & Biotechnology News 29, 56-57.

[161]    Vaidyanathan, S. Fletcher, J.S., Jarvis, R.M., Henderson, A., Lockyer, N.P, Goodacre, R. & Vickerman, J.C. (2009) Explanatory multivariate analysis of ToF-SIMS spectra for the discrimination of bacterial isolates. Analyst 134, 2352-2360.

[160]    Begley, P., Francis-McIntyre, S., Dunn, W.B., Broadhurst, D.I., Halsall, A., Tseng, A., Knowles, J., HUSERMET consortium, Goodacre, R. & Kell, D.B. (2009) Development and performance of a GC-TOF-MS analysis for large-scale untargeted metabolomic studies of human serum. Analytical Chemistry 81, 7038-7046.

[159]    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. (2009) Biomarkers of dietary energy restriction in women at increased risk of breast cancer. Cancer Prevention Research 2, 720-731.

[158]    Shadi, I.T., Cheung. W. & Goodacre, R. (2009) Quantitative analysis of methyl green using surface enhanced resonance Raman scattering.  Analytical and Bioanalytical Chemistry 394, 1833-1838.

[157]     Brown, M., Dunn, W.B., Dobson, P., Patel, Y., Winder, C.L., Francis-McIntyre, S., Begley, P., Carroll, K., Broadhurst, B., Tseng, A., Swainston, N., Spasic, I., Goodacre, R. & Kell, D.B. (2009) Mass spectrometry tools and metabolite-specific databases for molecular identification in metabolomics. Analyst 134, 1322-1332.

[156]    Biais, B., Allwood, J.W., Deborde, C., Xu, Y., Maucourt, M., Beauvoit, B., Dunn, W.B., Jacob, D., Goodacre, R., Rolin, D. & Moing, A. (2009) 1H NMR, GC-EI-TOFMS, and data set correlation for fruit metabolomics: application to spatial metabolite analysis in melon.  Analytical Chemistry 81, 2884-2894.

[155]    Jansen, J.J., Allwood, J.W., Marsden-Edwards, E., van der Putten, W.H., Goodacre, R. & van Dam, N.M. (2009) Metabolomic analysis of the interaction between plants and herbivores. Metabolomics 5, 150-161.

[154]    Cheung, W., Xu, Y., Thomas, C.L. P. & Goodacre, R. (2009) Discrimination of bacteria using pyrolysis-gas chromatography-differential mobility spectrometry (Py-GC-DMS) and chemometrics. Analyst 134, 557-563.

[153]    Brewster, V.L., Jarvis, R.M. & Goodacre, R. (2009) Raman spectroscopic techniques for biotechnology and bioprocessing.  European Pharmaceutical Review 14, 48-52.

[152]    Patel, S.A., Barnes, A., Loftus, N., Martin, R., Sloan, P., Thakker, N. & Goodacre, R. (2009) Imaging mass spectrometry using chemical inkjet printing reveals differential protein expression in human oral squamous cell carcinoma. Analyst 134, 301-307.

[151]    Sellick, C., Hansen, R., Maqsood, A., Dunn, W., Stephens, G., Goodacre, R. & Dickson, A. (2009) Effective quenching processes for physiologically valid metabolite profiling of suspension cultured mammalian cells. Analytical Chemistry 81, 174-183.

[150]    Patel, S.A., Currie, F., Thakker, N. & Goodacre, R. (2008) Spatial metabolic fingerprinting using FT-IR spectroscopy: investigating abiotic stresses on Micrasterias hardyi. Analyst 133, 1707-1713.

[149]    Faulds, K., Jarvis, R.M., Smith, W.E., Graham, D. & Goodacre, R., (2008) Multiplexed detection of labelled oligonucleotides using surface enhanced resonance Raman scattering (SERRS). Analyst 133, 1505-1512. Supplementary Information.

[148]    Jarvis, R.M., Johnson, H.E., Olembe, E., Panneerselvam, A., Malik, M.A., Azad, M., O'Brien, P. & Goodacre, R. (2008) Towards quantitatively reproducible substrates for SERS.  Analyst 133, 1449-1452. Supplementary Information.

[147]    Nicolaou, N. & Goodacre, R. (2008) Rapid and quantitative detection of the microbial spoilage in milk using Fourier transform infrared spectroscopy and chemometrics. Analyst 133, 1424-1431.

[146]    Jarvis, R.M., Law, N., Shadi, I.T., O'Brien, P., Lloyd, J. & Goodacre, R. (2008) Surface-enhanced Raman scattering from intracellular and extracellular bacterial locations. Analytical Chemistry 80, 6741-6746.

[145]    MacKenzie, D.A., Defernez, M., Dunn, W.B., Brown, M., Fuller, L.J., Seco de Herrera, S.R.M., Günther, A., James, S.A., Eagles, J., Philo, M., Goodacre, R. & Roberts, I.N. (2008) Relatedness of medically important strains of Saccharomyces cerevisiae as revealed by phylogenetics and metabolomics. Yeast 25, 501-512.

[144]    Cornmell, R.J., Winder, C.L., Tiddy, G.J.T., Goodacre, R. & Stephens, G. (2008) Accumulation of ionic liquids in Escherichia coli cells. Green Chemistry 10, 836-841.

[143]    Cossins, A., Hayward, S., Gossage, S. & Goodacre, R. (2008) Dissecting the mechanisms of environmental stress adaptation: A systems biology approach. Comparative Biochemistry and Physiology A-Molecular & Integrative Physiology 150, S43-S43.

[142]    Cornmell, R.J., Winder, C.L., Schuler, S., Goodacre, R. & Stephens, G. (2008) Using a biphasic ionic liquid / water reaction system to improve oxygenase-catalysed biotransformation with whole cells.  Green Chemistry 10, 685-691.

[141]    Jarvis, R.M. & Goodacre, R. (2008) Characterisation and identification of bacteria using SERS. Chemical Society Reviews 37, 931-936.

[140]    Winder, C.L., Dunn, W.B., Schuler, S., Broadhurst, D., Jarvis, R.M., Stephens, G.M. & Goodacre, R. (2008). Global metabolic profiling of Escherichia coli cultures: an evaluation of methods for quenching and extraction of intracellular metabolites. Analytical Chemistry 80, 2939-2948.  Supplementary Information.

[139]    Vaidyanathan, S., Fletcher, J.S., Goodacre, R., Lockyer, N.P., Micklefield, J. & Vickerman, J.C. (2008) Subsurface biomolecular imaging of Streptomyces coelicolor using secondary ion mass spectrometryAnalytical Chemistry 80, 1942-1951.

[138]    Allwood, J.W., Ellis, D.I. & Goodacre, R. (2008) Metabolomic technologies and their application to the study of plants and plant-host interactions. Physologia Plantarum 132, 117-135.

[137]    Brown, D.M., Goubet, F., Wong, V.W., Goodacre, R., Stephens, E., Dupree, P. & Turner, S.R. (2007) Comparison of five xylan synthesis mutants reveals new insight into the mechanisms of xylan synthesis. Plant Journal 52, 1154-1168.

[136]    Goodacre, R., Roberts, L., Ellis, D.I., Thorogood, D., Reader, S.M., Ougham, H. & King, I. (2007) From phenotype to genotype: whole tissue profiling for plant breedingMetabolomics 3, 489-501.

[135]    Ellis, D.I., Dunn, W.B., Griffin, J.L., Allwood, J.W. and Goodacre, R. (2007) Metabolic fingerprinting as a diagnostic tool. Pharmacogenomics 8, 1243-1266.

[134]    Jarvis, R.M., Blanch, E.W., Golovanov, A.P., Screen, J. & Goodacre, R. (2007) Quantification of casein phosphorylation with conformational interpretation using Raman spectroscopy. Analyst 132, 1053-1060.

[133]    Goodacre, R., Broadhurst, D., Smilde, A., Kristal, B.S., Baker, J.D., Beger, R., Bessant, C., Connor, S., Capuani, G., Craig, A., Ebbels, T., Kell, D.B., Manetti, C., Newton, J., Paternostro, G., Somorjai, R., Sjöström, M., Trygg, J. & Wulfert, F. (2007) Proposed minimum reporting standards for data analysis in metabolomics. Metabolomics 3, 231-241.

[132]    Sumner, L.W., Amberg, A., Barrett, D., Beger, R., Beale, M.H., Daykin, C., Fan, T.W.-M., Fiehn, O., Goodacre, R., Griffin, J.L., Hardy, N., Higashi, R., Kopka, J., Lindon, J.C., Lane, A.N., Marriott, P., Nicholls, A.W., Reily, M.D. & Viant, M. (2007) Proposed minimum reporting standards for chemical analysis. Metabolomics 3, 211-221.

[131]    Fiehn, O., Robertson, D., Griffin, J., van der Werf, M., Nikolau, B., Morrison, N., Sumner, L.W., Goodacre, R., Hardy, N.W., Taylor, C., Fostel, J., Kristal, B. Kaddurah-Daouk, R., Mendes, P., van Ommen, B., Lindon, J.C. & Sansone, S.-A. (2007) The metabolomics standards initiative (MSI). Metabolomics 3, 175-178.

[130]    Brison, D.R., Hollywood, K., Arnesen, R. & Goodacre, R. (2007) Predicting human embryo viability: the road to non-invasive analysis of the secretome using metabolic footprintingReproductive Biomedicine Online 15, 296-302.

[129]    Sansone, S.-A., Nikolau, B., van Ommen, B., Kristal, B.S., Taylor, C., Robertson, D., Lindon, J., Griffin, J.L., Sumner, L.W., van der Werf, M., Hardy, N.W., Morrison, N., Mendes, P., Kaddurah-Daouk, R., Goodacre, R., Fan, T. & Fiehn, O. (2007) The Metabolomics Standards Initiative (MSI)Nature Biotechnology 25, 846-849.

[128]    Pope, G.A., MacKenzie, D.A., Defernez, M., Aroso, M.A.M.M., Fuller, L.J., Mellon, F.A., Dunn, W.B., Brown, M., Goodacre, R., Kell, D.B., Marvin, M.E., Louis, E.J. & Roberts, I.N. (2007) Metabolic footprinting as a tool for discriminating between brewing yeasts. Yeast 24, 667-679.

[127]    Vaidyanathan, S., Jones, D., Ellis, J., Jenkins, T., Ching, C., Anderson, M. & Goodacre, R. (2007) Laser desorption/ionization mass spectrometry on porous silicon for metabolome analyses: influence of surface oxidation. Rapid Communications in Mass Spectrometry 21, 2157-2166.

[126]    Vaidyanathan, S. & Goodacre, R. (2007) Quantitative detection of metabolites using matrix-assisted laser desorption ionization mass spectrometry and 9-aminoacridine as matrix. Rapid Communications in Mass Spectrometry 21, 2072-2078.

[125]    Goodacre, R. (2007) Metabolomics of a superorganism. Journal of Nutrition 137, 259S-266S.

[124]    Harrison, B., Ellis, J., Broadhurst, D., Reid, K., Goodacre, R. & Priest, F.G. (2006) Differentiation of peats used in the preparation of malt for Scotch whisky production using Fourier transform infrared spectroscopy. Journal of the Institute of Brewing 112, 333-339.

[123]    Jarvis, R., Clarke, S. & Goodacre, R. (2006) Rapid analysis of microbiological systems using SERS. Topics in Applied Physics 103, 397-408.

[122]    Bayat, A., Winder, C., Stanley, J., Day, P. & Goodacre, R. (2006) Proteome analysis of dupuytren's disease differentiating between disease tissue phenotypes (nodule, cord and transverse palmar fascia) and control palmar fascia. The Journal of Hand Surgery: Journal of the British Society for Surgery of the Hand 31 Suppl 1, 5.

[121]    Jarvis, R.M., Broadhurst, D., Johnson, H.E., O'Boyle, N.M. & Goodacre, R. (2006) PYCHEM: a multivariate analysis package for Python. Bioinformatics 22, 2565-2566.

[120]    Huang, W.E., Hopper, D., Goodacre, R., Beckmann, M., Singer, A. & Draper, J. (2006) Rapid characterization of microbial biodegradation pathways by FT-IR spectroscopy.  Journal of Microbiological Methods 67, 273-280.

[119]    Winder, C.L., Gordon, S.V., Dale, J., Hewinson, R.G. & Goodacre, R. (2006) Metabolic fingerprints of Mycobacterium bovis cluster with molecular type: implications for genotype-phenotype links. Microbiology 152, 2757-2765.

[118]    Hollywood, K., Brison, D.R. & Goodacre, R. (2006) Metabolomics: current technologies and future trends.  Proteomics 6, 4716-4723.

[117]    Fletcher, J.S., Henderson, A., Jarvis, R.M., Lockyer, N.P., Vickerman, J.C. & Goodacre, R. (2006) Rapid discrimination of the causal agents of urinary tract infection using ToF-SIMS with chemometric cluster analysis. Applied Surface Science 252, 6869-6874.

[116]    Thompson, C.E., Ellis, J. Fletcher, J.S., Goodacre, R., Henderson, A., Lockyer, N.P. & Vickerman, J.C. (2006) ToF-SIMS studies of Bacillus using multivariate analysis with possible identification and taxonomic applications. Applied Surface Science 252, 6719-6722.

[115]    Ellis, D.I. & Goodacre, R. (2006) Metabolic fingerprinting in disease diagnosis: biomedical applications of infrared and Raman spectroscopy. Analyst 131, 875-885.

[114]    Gidman, E.A., Stephens, C.J., Goodacre, R., Broadhurst, D., Emmett, B. & Gwynn-Jones, D. (2006) Using metabolic fingerprinting of plants for evaluating nitrogen deposition impacts on the landscape level. Global Change Biology 12, 1460-1465.

[113]    Allwood, J.W., Ellis, D.I., Heald, J.K., Goodacre, R. & Mur. L,A.J. (2006) Metabolomic approaches reveal that phosphatidic and phosphatidyl glycerol phospholipids are major discriminatory metabolites in responses by Brachypodium distachyon to challenge by Magnaporthe grisea. Plant Journal 46, 351-368.

[112]    Vaidyanathan, S., Gaskell, S. & Goodacre R. (2006) Matrix suppressed laser desorption ionization mass spectrometry and its suitability for metabolome analyses.  Rapid Communications in Mass Spectrometry 20, 1192-1198.

[111]    Maddox, J.F., Luyendyk, J.P., Cosma, G.N., Breau, A.P., Bible, Jr., R.H., Harrigan, G.G., Goodacre, R., Ganey, P.E., Cantor, G.H., Cockerell, G.L. & Roth, R.A. (2006) Metabonomic evaluation of idiosyncrasy-like liver injury in rats cotreated with ranitidine and lipopolysaccharide.  Toxicology and Applied Pharmacology 212, 35-44.

[110]    Jarvis, R.M., Brooker, A. & Goodacre, R. (2006) Surface-enhanced Raman scattering for the rapid discrimination of bacteria.  Faraday Discussion 132, 281-292.

[109]    Vaidyanathan, S., O'Hagan, S. & Goodacre R. (2006) Direct infusion electrospray ionization mass spectra of crude cell extracts for microbial characterizations: influence of solvent conditions on the detection of proteins.  Rapid Communications in Mass Spectrometry 20, 21-30.

[108]    Zhao, H., Parry, R.L., Ellis, D.I., Griffith, G.W. & Goodacre, R. (2006) The rapid differentiation of Streptomyces isolates using Fourier transform infrared spectroscopy.  Vibrational Spectroscopy 40, 213-218.

[107]    Kassama, Y., Shemko, M., Shetty, N., Fang, Z., MacIntire, G., Gant, V., Zumula, A. & Goodacre, R. (2006) An improved FAFLP method for typing M. tuberculosis. Journal of Clinical Microbiology 44, 288-289.

[106]    Huang, W.E., Goodacre, R., Elliott, G.N., Beckmann, M., Worgan, H., Bailey, M.J., Williams, P.A., Scullion, J. & Draper, J. (2005) Chemical fingerprinting for monitoring metabolic changes in artificial soil slurries caused by genetic transformation of Acinetobacter.  Metabolomics 1, 305-315.

[105]    Gidman, E.A., Goodacre, R., Emmett, B., Wilson, D.B., Carroll, J.A., Caporn, S.J.M., Cresswell, N. & Gwynn-Jones, D. (2005) Metabolic fingerprinting for bio-indication of nitrogen responses in Calluna vulgaris heath communities. Metabolomics 1, 279-285.

[104]    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. (2005) A laser desorption ionisation mass spectrometry approach for high throughput metabolomics. Metabolomics 1, 243-250.

[103]    Goodacre, R. & Jarvis, R.M. (2005) Raman spectroscopy: applications in bioprocesses and biotechnology.  European Pharmaceutical Review 11, 72-77.

[102]    Ellis, D.I., Broadhurst, D., Clarke, S.J. & Goodacre, R. (2005) Rapid identification of closely related muscle foods by vibrational spectroscopy and machine learning.  Analyst 130, 1648-1654.

[101]    Brown, D.M., Zeef, L., Ellis, J., Goodacre, R. & Turner, S.R. (2005) Identification of novel genes involved in secondary cell wall formation using expression profiling and reverse genetics. Plant Cell 17, 2281-2295.

[100]    Clarke, S.J., Littleford, R.E., Smith, W.E. & Goodacre, R. (2005) Rapid monitoring of antibiotics using Raman and surface enhanced Raman spectroscopy.  Analyst 130, 1019-1026.

[99]      López-Díez, E.C., Winder, C.L., Ashton, L., Currie, F. & Goodacre, R. (2005) Monitoring the mode of action of antibiotics using Raman spectroscopy: investigating sub-inhibitory effects of amikacin on Pseudomonas aeruginosa. Analytical Chemistry 77, 2901-2906.

[98]      Jarvis, R.M. & Goodacre, R. (2005) Genetic algorithm optimisation for pre-processing and variable selection of spectroscopic data. Bioinformatics 21, 860-868.

[97]      Brown, M., Dunn, W.B., Ellis, D.I., Goodacre, R., Handl, J., Knowles, J.D., O'Hagan, S., Spasić, I. & Kell, D.B. (2005) A metabolome pipeline: from concept to data to knowledge. Metabolomics 1, 39-51.

[96]      Goodacre, R. (2005) Making sense of the metabolome using evolutionary computation: seeing the wood with the trees. Journal of Experimental Botany 56, 245-254.

[95]      Gidman, E., Goodacre, R., Emmett, B., Sheppard, L.J., Leith, I.D. & Gwynn-Jones, D. (2004) Applying metabolic fingerprinting to ecology: The use of Fourier-transform infrared spectroscopy for the rapid screening of plant responses to N deposition. Water, Air and Soil Pollution 4, 251-258.

[94]      Jenkins, H., Hardy, N., Beckmann, M., Draper, J., Smith, A.R., Taylor, J., Fiehn, O., Goodacre, R., Bino, R., Hall, R., Kopka, J., Lane, G.A., Lange, B.M., Liu, J.R., Mendes, P., Nikolau, B.J., Oliver, S.G., Paton, N.W., Roessner-Tunali, U., Saito, K., Smedsgaard, J. Sumner, L.W., Wang, T., Walsh, S., Wurtele, E.S., Kell, D.B. (2004) A proposed framework for the description of plant metabolomics experiments and their results. Nature Biotechnology 22, 1601-1606.

[93]      Zhao, H.J., Kassama, Y., Young, M., Kell, D.B. & Goodacre R. (2004) Characterisation of Micromonospora isolates from a coastal sediment in Wales based on Fourier transform infrared spectroscopy, 16S rDNA sequence analysis, and the amplified fragment length polymorphism technique. Applied and Environmental Microbiology 70, 6619-6627.

[92]      Winder, C.L. & Goodacre, R. (2004) Comparison of diffuse-reflectance absorbance and attenuated total reflectance FT-IR for the discrimination of bacteria. Analyst 129, 1118-1122.

[91]      Jarvis, R.M., Brooker, A. & Goodacre, R. (2004) Surface-enhanced Raman scattering for bacterial characterisation using a scanning electron microscope with a Raman spectroscopy interface. Analytical Chemistry 76, 5198-5202.

[90]      Vaidyanathan, S., Kell, D.B. & Goodacre, R. (2004) Selective detection of proteins in mixtures using electrospray ionization mass spectrometry: influence of instrumental settings and implications for proteomics. Analytical Chemistry 76, 5024-5032.

[89]      Ellis, D.I., Broadhurst, D.I. & Goodacre, R. (2004) Rapid and quantitative detection of the microbial spoilage of beef by Fourier transform infrared spectroscopy and machine learning. Analytica Chimica Acta 514, 193-201.

[88]      Goodacre, R. Vaidyanathan, S., Dunn, W.B., Harrigan, G.G. & Kell, D.B. (2004) Metabolomics by numbers - acquiring and understanding global metabolite data.  Trends in Biotechnology 22, 245-252.

[87]      Lai, S., Goodacre R. & Manchester, L.N. (2004) Whole-organism fingerprinting of the genus Carnobacterium using Fourier transform infrared (FT-IR) spectroscopy.  Systematics and Applied Microbiology 27, 186-191.

[86]      Jarvis, R.M. & Goodacre, R. (2004) Ultra-violet resonance Raman spectroscopy for the rapid discrimination of urinary tract infection bacteria. FEMS Microbiology Letters 232, 127-132.

[85]      López-Díez, E.C. & Goodacre, R. (2004) Characterisation of microorganisms using UV resonance Raman spectroscopy and chemometrics. Analytical Chemistry 76, 585-591.

[84]      Winder, C.L., Carr, E., Goodacre, R. & Seviour, R. (2004) The rapid identification of Acinetobacter species using Fourier transform infrared spectroscopy. Journal of Applied Microbiology 96,328-339.

[83]      Jarvis, R.M. & Goodacre, R. (2004) Rapid discrimination of bacteria using surface enhanced Raman spectroscopy. Analytical Chemistry 76, 40-47.

[82]      Harrigan, G.G., LaPlante, R.H., Cosma, G.N., Cockerell, G., Goodacre, R., Maddox, J.F., Ludyenck, J.P., Ganey, P.E. & Roth, R.A. (2004) 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.  Toxicology Letters 146, 197-205.

[81]      Vaidyanathan, S., Broadhurst, D.I., Kell D.B. & Goodacre, R. (2003) Explanatory optimisation of protein mass spectrometry via genetic search.  Analytical Chemistry 75, 6679-6686.

[80]      Scullion, J., Goodacre, R., Elliott, G., Huang, W., Worgan, H., Gwynn-Jones, D., Griffith, G.W., Darby, R., Bailey, M.J., Clegg, C. & Draper, J. (2003) Food quality and microbial succession in ageing earthworm casts: standard microbial indices and metabolic fingerprinting.  Pedobiologia 47, 888-894.

[79]      Gwynn-Jones, D., Huang, W., Easton, G., Goodacre, R. & Scullion, J. (2003) UV-B radiation induced changes in litter quality affects earthworm growth and cast characteristics as determined by metabolic fingerprinting.  Pedobiologia 47, 784-787.

[78]      Scullion, J., Elliott, G.N., Huang, W.E., Goodacre, R., Worgan, H., Darby, R., Bailey, M.J., Gwynn-Jones, D., Griffith, G.W., Winson, M.K., Williams, P.A., Clegg, C. & Draper, J., (2003) Use of earthworm casts to validate FT-IR spectroscopy as a 'sentinel' technology for high-throughput monitoring of global changes in microbial ecology.  Pedobiologia 47, 440-446.

[77]      López-Díez, E.C., Bianchi, G. & Goodacre, R. (2003) Rapid quantitative assessment of the adulteration of virgin olive oils with hazelnut oils using Raman spectroscopy and chemometrics.  Journal of Agricultural and Food Chemistry 51, 6145-6150.

[76]      Kaderbhai, N.N., Broadhurst, D.I., Ellis, D.I., Goodacre, R. & Kell, D.B. (2003) Functional genomics via metabolic footprinting: monitoring metabolite secretion by Escherichia coli tryptophan metabolism mutants using FT-IR and direct injection electrospray mass spectrometry. Comparative and Functional Genomics 4, 376-391.

[75]      Goodacre, R. (2003) Explanatory analysis of spectroscopic data using machine learning of simple, interpretable rules.  Vibrational Spectroscopy 32, 33-45.

[74]      Gidman, E., Goodacre, R., Emmett, B., Smith, A.R. & Gwynn-Jones, D. (2003) Investigating plant-plant interference by metabolic fingerprinting.  Phytochemistry 63, 705-710.

[73]      Johnson, H.E., Broadhurst, D., Goodacre, R. & Smith, A.R. (2003) Metabolic fingerprinting in salt-stressed tomatoes.  Phytochemistry 62, 919-928.

[72]      Goodacre, R., York, E.V., Heald, J.K. & Scott, I.M. (2003) Chemometric discrimination of unfractionated plant extracts profiled by flow-injection electrospray mass spectrometry.  Phytochemistry 62, 859-863.

[71]      Goodacre, R., Vaidyanathan, S., Bianchi, G. & Kell, D.B. (2002) Metabolic profiling using direct infusion electrospray ionisation mass spectrometry for the characterisation of olive oils.  The Analyst 11, 1457-1462.

[70]      Kassama, Y., Rooney, P.J. & Goodacre, R. (2002) A fluorescent amplified fragment length polymorphism probabilistic database for the identification of bacterial isolates from urinary tract infections.  Journal of Clinical Microbiology 40, 2795-2800.

[69]      Vaidyanathan, S., Winder, C.L., Wade, S.C., Kell, D.B. & Goodacre, R. (2002) Sample preparation in matrix-assisted laser desorption/ionization mass spectrometry of whole bacterial cells and the detection of high mass (>20 kDa) proteins.  Rapid Communications in Mass Spectrometry 16, 1276-1286.

[68]      Ellis, D.I., Broadhurst, D., Kell, D.B., Rowland, J.J. & Goodacre, R. (2002) Rapid and quantitative detection of the microbial spoilage of meat using FT-IR spectroscopy and machine learning. Applied and Environmental Microbiology 68, 2822-2828.

[67]      McGovern, A.C., Broadhurst, D., Taylor, J., Kaderbhai, N., Winson, M.K., Small, D.A., Rowland, J.J., Kell, D.B. & Goodacre, R. (2002) Monitoring of complex industrial bioprocesses for metabolite concentrations using modern spectroscopies and machine learning: application to gibberellic acid production. Biotechnology and Bioengineering 78, 527-538.

[66]      Goodacre, R., Radovic, B.S. & Anklam, A. (2002) Progress toward the rapid non-destructive assessment of the floral origin of European honey using dispersive Raman spectroscopy.  Applied Spectroscopy 56, 521-527.

[65]      Vaidyanathan, S., Kell, D.B. & Goodacre, R. (2002) Flow-injection electrospray ionization mass spectrometry of crude cell extracts for high-throughput bacterial identification.  Journal of the American Society of Mass Spectrometry 13, 118-128.

[64]      Ellis, D.I. & Goodacre, R. (2001) Rapid and quantitative detection of the microbial spoilage of muscle foods: current status and future trends.  Trends in Food Science and Technology 12, 414-424.

[63]      Schuster, K.C., Goodacre, R., Gapes, J.R. & Young, M. (2001) Degeneration of solventogenic Clostridium strains monitored by Fourier transform infrared spectroscopy of bacterial cells.  Journal of Industrial Microbiology and Biotechnology 27, 314-321.

[62]      Goodacre, R. & Anklam, E. (2001) Fourier-transform infrared spectroscopy and chemometrics as a tool for the rapid detection of other vegetable fats mixed in cocoa butter.  Journal of the American Oil Chemists' Society 78, 993-1000.

[61]      Vaidyanathan, S., Rowland, J.J., Kell, D.B. & Goodacre, R. (2001) Discrimination of aerobic endospore-forming bacteria via electrospray-ionisation mass spectrometry of whole cell suspensions.  Analytical Chemistry 73, 4134-4144.

[60]      Radovic, B.S., Goodacre, R. & Anklam, E. (2001) Contribution of pyrolysis mass spectrometry (Py-MS) to authenticity testing of honey.  Journal of Analytical and Applied Pyrolysis 60, 79-87.

[59]      Beavis, R.C., Colby, S.M., Goodacre, R. Harrington, P.B., Reilly, J.P., Sokolow, S. & Wilkerson, C.W. (2000) Artificial intelligence and expert systems in mass spectrometry.  In Encyclopedia of Analytical Chemistry. Ed. Meyers, R.A., pp. 11558-11597.

[58]      Johnson, H.E., Gilbert, R.J., Winson, M.K., Goodacre, R., Smith, A.R., Rowland, J.J., Hall, M.A. & Kell, D.B. (2000). Explanatory analysis of the metabolome using genetic programming of simple, interpretable rules. Genetic Programming and Evolvable Machines 1, 243-258.

[57]      Thomas, N., Goodacre, R. Timmins, É.M., Gaudoin, M. & Fleming R. (2000) Fourier transform infrared spectroscopy of follicular fluids from large and small antral follicles.  Human Reproduction 15, 1667-1671.

[56]      Goodacre, R., Shann, B., Gilbert, R.J., Timmins, É.M., McGovern, A.C., Alsberg, B.K., Kell, D.B. & Logan, N.A. (2000) The detection of the dipicolinic acid biomarker in Bacillus spores using Curie point pyrolysis mass spectrometry and Fourier transform infrared spectroscopy.  Analytical Chemistry 72, 119-127.

[55]     Shaw, A.D., Winson, M.K., Woodward, A.M., McGovern, A.C., Davey, H.M., Kaderbhai, N., Broadhurst, D., Gilbert, R.J., Taylor, J., Timmins, É.M., Alsberg, B.K., Rowland, J.J., Goodacre, R. & Kell, D.B. (1999) Rapid analysis of high-dimensional bioprocesses using multivariate spectroscopies and advanced chemometrics.  Advances in Biochemical Engineering and Biotechnology 66, 83-113.

[54]    Shaw, A.D., Kaderbhai, N., Jones, A., Woodward, A.M., Goodacre, R., Rowland, J.J. & Kell, D.B.  (1999) Non-invasive, on-line monitoring of the biotransformation by yeast of glucose to ethanol using dispersive Raman spectroscopy and chemometrics. Applied Spectroscopy 53, 1419-1428.

[53x]    Thomas, N., Goodacre, R., Timmins, É.M., Mitchell, P., Jamieson, M., Yates, R. & Fleming, R. (1999) Fourier transform infra-red (FT IR) spectroscopy of follicular fluids from antral follicles.  Human Reproduction 14 (S1), P066, 173-174.

[52]      Goodacre, R. & Gilbert, R.J. (1999) The detection of caffeine in a variety of beverages using Curie-point pyrolysis mass spectrometry and genetic programming.  The Analyst 124, 1069-1074.

[51]      McGovern, A.C., Ernill, R., Kara, B.V., Kell, D.B. & Goodacre, R. (1999).  Rapid analysis of the expression of heterologous proteins in Escherichia coli using pyrolysis mass spectrometry and Fourier transform infrared spectroscopy with chemometrics: application to a2-interferon production.  Journal of Biotechnology 72, 157-167.

[50]      Goodacre, R. Heald, J.K. & Kell, D.B. (1999) Characterisation of intact microorganisms using electrospray ionization mass spectrometry.  FEMS Microbiology Letters 176, 17-24.

[49]      Goshawk, J.A., Binding, D.M., Kell, D.B. & Goodacre, R. (1998) Rheological phenomena occuring during the shearing flow of mayonnaise.  Journal of Rheology 42, 1537-1553.

[48x]    Goodacre, R. (1998) Food, glorious food - a bacterial paradise.  New Food 1, 44-48.

[47]      Alsberg, B.K., Kell, D.B. & Goodacre, R.  (1998) Variable selection in discriminant partial least squares analysis. Analytical Chemistry 70, 4126-4133.

[46]      Timmins, É.M., Quain, D.E. & Goodacre, R. (1998) Differentiation of brewing yeast strains by pyrolysis mass spectrometry and Fourier transform infrared spectroscopy.  Yeast 14, 885-893.

[45]      Alsberg, B.K., Wade, W.G. & Goodacre, R. (1998) Chemometric analysis of diffuse reflectance-absorbance Fourier transform infrared spectra using rule induction methods: application to the classification of Eubacterium species.  Applied Spectroscopy 52, 823-832.

[44]      Goodacre, R., Timmins, É.M., Burton, R., Kaderbhai, N., Woodward, A.M., Kell, D.B. & Rooney, P.J. (1998) Rapid identification of urinary tract infection bacteria using hyperspectral, whole organism fingerprinting and artificial neural networks. Microbiology 144, 1157-1170.

[43]      Taylor, J., Goodacre, R., Wade, W.G., Rowland, J.J. & Kell, D.B. (1998) The deconvolution of pyrolysis mass spectra using genetic programming: application to the identification of some Eubacterium species.  FEMS Microbiology Letters 160, 237-246.

[42]      Timmins, É.M., Howell, S.A., Alsberg, B.K., Noble, W.C. & Goodacre, R. (1998) Rapid differentiation of closely related Candida species and strains by pyrolysis mass spectrometry and Fourier transform infrared spectroscopy.  Journal of Clinical Microbiology 36, 367-374.

[41]      Goodacre, R., Rooney, P.J. & Kell, D.B. (1998) Discrimination between methicillin-resistant and methicillin-susceptible Staphylococcus aureus using pyrolysis mass spectrometry and artificial neural networks.  Journal of Antimicrobial Chemotherapy 41, 27-34.

[40]      Goodacre, R. Harvey, R., Howell, S.A., Greenham, L.W. & Noble, W.C. (1997) An epidemiological study of some Staphylococcus intermedius strains isolated from dogs, their owners and veterinary surgeons.  Journal of Analytical and Applied Pyrolysis 44, 49-64.

[39]      Gilbert, R.J., Goodacre, R., Woodward, A.M. & Kell, D.B. (1997) Genetic programming : a novel method for the quantitative analysis of pyrolysis mass spectral data.  Analytical Chemistry 69, 4381-4389.

[38]      Goodacre, R., Timmins, É.M., Jones, A., Kell, D.B., Maddock, J., Heginbothom, M.L. & Magee, J.T.  (1997) On mass spectrometer instrument standardization and interlaboratory calibration transfer using neural networks.  Analytica Chimica Acta 348, 511-532.

[37]      Alsberg, B.K., Goodacre, R., Rowland, J.J. & Kell, D.B.  (1997) Classification of pyrolysis mass spectra by fuzzy multivariate rule induction - comparison with regression, K-nearest neighbour, neural and decision-tree methods.  Analytica Chimica Acta 348, 389-407.

[36]      Winson, M.K., Goodacre, R., Woodward, A.M., Timmins, É.M., Jones, A., Alsberg, B.K., Rowland, J.J. & Kell, D.B.  (1997) Diffuse reflectance absorbance spectroscopy taking in chemometrics (DRASTIC). A hyperspectral FT-IR-based approach to rapid screening for metabolite overproduction.  Analytica Chimica Acta 348, 273-282.

[35]      Broadhurst, D., Goodacre, R., Jones, A, Rowland, J.J. & Kell, D.B. (1997) Genetic algorithms as a method for variable selection in PLS regression, with application to pyrolysis mass spectra.  Analytica Chimica Acta 348, 71-86.

[34]      Goodacre, R. (1997) Use of pyrolysis mass spectrometry with supervised learning for the assessment of the adulteration of milk of different species.  Applied Spectroscopy 51, 1144-1153.

[33]      Timmins, É.M. & Goodacre, R. (1997) Rapid quantitative analysis of binary mixtures of Escherichia coli strains using pyrolysis mass spectrometry with multivariate calibration and artificial neural networks.  Journal of Applied Microbiology 83, 208-218.

[32]      Salter, G.J., Lazzari, M., Giansante, L., Goodacre, R., Jones, A., Surricchio, G., Kell, D.B. & Bianchi, G. (1997) Determination of the geographical origin of Italian extra virgin olive oil using pyrolysis mass spectrometry and artificial neural networks.  Journal of Analytical and Applied Pyrolysis 40/41, 159-170.

[31]      Goodacre, R., Hammond, D. & Kell, D.B. (1997) Quantitative analysis of the adulteration of orange juice with sucrose using pyrolysis mass spectrometry and chemometrics.  Journal of Analytical and Applied Pyrolysis 40/41, 135-158.

[30]      Goodacre, R., Rischert, D.J., Evans, P.M. & Kell, D.B. (1996) Rapid authentication of animal cell lines using pyrolysis mass spectrometry and auto-associative artificial neural networks.  Cytotechnology 21, 231-241.

[29x]    Goodacre, R., Neal, M.J. & Kell, D.B. (1996) Quantitative analysis of multivariate data using artificial neural networks: a tutorial review and applications to the deconvolution of pyrolysis mass spectra. Zentralblatt für Bakteriologie - International Journal of Medical Microbiology, Virology, Parasitology and Infectious Diseases 284, 516-539.

[28x]      Goodacre, R., Howell, S.A., Noble, W.C. and Neal, M.J. (1996) Sub-species discrimination, using pyrolysis mass spectrometry and self-organising neural networks, of Propionibacterium acnes isolated from normal human skin.  Zentralblatt für Bakteriologie - International Journal of Medical Microbiology, Virology, Parasitology and Infectious Diseases 284, 501-515.

[27]      Goodacre, R., Pygall, J. & Kell, D.B. (1996) Plant seed classification using pyrolysis mass spectrometry with unsupervised learning; the application of auto-associative and Kohonen artificial neural networks.  Chemometrics and Intelligent Laboratory Systems 34, 69-83.

[26]      Goodacre, R. Timmins, É.M., Rooney, P.J., Rowland, J.J. & Kell, D.B. (1996) Rapid identification of Streptococcus and Enterococcus species using diffuse reflectance-absorbance Fourier transform infrared spectroscopy and artificial neural networks.  FEMS Microbiology Letters 140, 233-239.

[25]      Goodacre, R. & Kell, D.B. (1996) Correction of mass spectral drift using artificial neural networks.  Analytical Chemistry 68, 271-280.

[24]      Goodacre, R., Hiom, S.J., Cheeseman, S.L. Murdoch, D., Weightman, A.J. & Wade, W.G. (1996) Identification and discrimination of oral asaccharolytic Eubacterium spp. by pyrolysis mass spectrometry and artificial neural networks.  Current Microbiology 32, 77-84.

[23]      Goodacre, R. & Kell, D.B. (1996) Pyrolysis mass spectrometry and its applications in biotechnology.  Current Opinion in Biotechnology 7, 20-28.

[22]      Goodacre, R., Trew, S., Wrigley-Jones, C., Saunders, G., Neal, M.J., Porter, N. & Kell, D.B. (1995) Rapid and quantitative analysis of metabolites in fermentor broths using pyrolysis mass spectrometry with supervised learning: application to the screening of Penicillium chrysogenum fermentations for the overproduction of penicillins.  Analytica Chimica Acta 313, 25-43.

[21]      Neal, M.J., Goodacre, R., Hiom, S., Weightman, A.J. & Wade, W.G. (1995) Identification and discrimination of oral Eubacterium spp. using pyrolysis mass spectrometry. Journal of Dental Research 74, 886.

[20x]   Goodacre, R., Kell, D.B. & Bianchi, G. (1995) Food adulteration exposed by neural networks.  Analysis Europa June, 35-37.

[19]      Wilkinson, S.R., Young, M., Goodacre, R., Morris, J.G., Farrow, J.A.E. & Collins, M.D. (1995) Phenotypic and genotypic differences between certain strains of Clostridium acetobutylicum.  FEMS Microbiology Letters 125, 199-204.

[18]    Manchester, L.N., Toole, A. & Goodacre, R. (1995) Characterisation of Carnobacterium species by pyrolysis mass spectrometry.  Journal of Applied Bacteriology 78, 88-96.

[17]      Goodacre, R., Trew, S., Wrigley-Jones, C., Neal, M.J., Maddock, J., Ottley, T.W. Porter, N. & Kell, D.B. (1994) Rapid screening for metabolite overproduction in fermentor broths using pyrolysis mass spectrometry with multivariate calibration and artificial neural networks.  Biotechnology and Bioengineering 44, 1205-1216.

[16]    Kay, H.E., Coutinho, H.L.C., Fattori, M., Manfio, G.P., Goodacre, R., Nut, M.P., Basaglia, M. & Beringer, J.E. (1994) The identification of Bradyrhizobium japonicum strains isolated from Italian soils.  Microbiology 140, 2333-2339.

[15]      Goodacre, R., Karim, A., Kaderbhai, M.A. & Kell, D.B. (1994) Rapid and quantitative analysis of recombinant protein expression using pyrolysis mass spectrometry and artificial neural networks: application to mammalian cytochrome b5 in Escherichia coli.  Journal of Biotechnology 34, 185-193.

[14x]    Goodacre, R. (1994) Characterisation and quantification of microbial systems using pyrolysis mass spectrometry: introducing neural networks to analytical pyrolysis.  Microbiology Europe 2(2), 16-22.

[13]      Goodacre, R., Neal, M.J. & Kell, D.B. (1994) Rapid and quantitative analysis of the pyrolysis mass spectra of complex binary and tertiary mixtures using multivariate calibration and artificial neural networks.  Analytical Chemistry 66, 1070-1085.

[12]    Freeman, R., Goodacre, R., Sisson, P.R., Magee, J.G., Ward, A.C. & Lightfoot, N.F. (1994) Rapid identification of species within the Mycobacterium tuberculosis complex by artificial neural network analysis of pyrolysis mass spectra.  Journal of Medical Microbiology 40, 170-173.

[11]    Goodacre, R., Neal, M.J., Kell, D.B., Greenham L.W., Noble, W.C. & Harvey, R.G. (1994) Rapid identification using pyrolysis mass spectrometry and artificial neural networks of Propionibacterium acnes isolated from dogs.  Journal of Applied Bacteriology 76, 124-134.

[10]    Goodacre, R., Kell, D.B. & Bianchi, G. (1993) Rapid assessment of olive oil adulteration using pyrolysis mass spectrometry and artificial neural networks.  Journal of the Science of Food and Agriculture 63, 297-307.

[9]        Goodacre, R., Edmonds, A.N. & Kell, D.B. (1993) Quantitative analysis of the pyrolysis-mass spectra of complex mixtures using artificial neural networks:  application to casamino acids in glycogen.  Journal of Analytical and Applied Pyrolysis 26, 93-114.

[8]        Goodacre, R. & Kell, D.B. (1993) Rapid and quantitative analysis of bioprocesses using pyrolysis mass spectrometry and neural networks: application to indole production.  Analytica Chimica Acta 279, 17-26.

[7x]      Goodacre, R., Kell, D.B. & Bianchi, G. (1993) Controllo della qualità dell'olio di oliva con la pirolisi-spettrometria di massa abbinata ad un sistema di "artificial neural networks".  [Olive oil quality control by using pyrolysis mass spectrometry and artificial neural networks].  Olivæ 47, 36-39.

[6]        Goodacre, R., Kell, D.B. & Bianchi, G. (1992) Neural networks and olive oil.  Nature 359, 594.

[5]        Goodacre, R., Beringer, J.E. & Berkeley, R.C.W. (1991) The use of pyrolysis-mass spectrometry to detect the fimbrial adhesive antigen F41 from Escherichia coli HB101(pSLM204).  Journal of Analytical and Applied Pyrolysis 22, 19-28.

[4]        Goodacre, R., Hartmann, A., Beringer, J.E. & Berkeley, R.C.W. (1991) The use of pyrolysis mass spectrometry in the characterization of Rhizobium meliloti.  Letters in Applied Microbiology 13, 157-160.

[3]        Ford, T., Sacco, E., Black, J., Kelley, T., Goodacre, R., Berkeley, R.C.W. & Mitchell, R. (1991) Characterization of exopolymers of aquatic bacteria by pyrolysis mass spectrometry.  Applied and Environmental Microbiology 57, 1595-1601.

[2x]        Berkeley, R.C.W., Goodacre, R., Helyer, R.J. & Kelley, T. (1990) Pyrolysis-mass spectrometry in the rapid identification of microorganisms.  Laboratory Practice 39 (10), 81-83.

[1]        Goodacre, R. & Berkeley, R.C.W. (1990) Detection of small genotypic changes in Escherichia coli by pyrolysis mass spectrometry. FEMS Microbiology Letters 71, 133-138.