Research
Metabolomics technologies collect vast quantities of data which must be processed in a suitable manner for the application. We have developed rigorous tests to ensure the validity of our methods and data analysis techniques to ensure robust data sets.
Publications
Journals
- McDougall, G.J.; Allwood, J.W.; Austin, C.; Dobson, G.; Verrall, S.; Alexander, C.J.; Hancock, R.D.; Graham, J.; Hackett, C. (2023) Quantitative trait loci mapping of polyphenol metabolites from a ‘Latham’ x ‘Glen Moy’ red raspberry (Rubus idaeus L) cross, Metabolomics, 19(8), Art. 7
- Scolari, L. M.; Hancock, R.; Graham, J.; Freitag, S.; Verrall, S.; Moreno-Melada, A. R.; Allwood, W. (2022) Hormone profiling in artificially induced ‘crumbly’ fruit in raspberry (Rubus idaeus L.) at two different development stages, The Journal of Horticultural Science and Biotechnology, 98(3), 384-393
- McLoone, P.; Tabys, D.; Yunussova, S.; Zhumbayeva, A.; Sungurtas, J.; Verrall, S.; Austin, C.; Allwood, W.; McDougall, G. (2022) Qualitative phytochemical analysis and in vitro investigation of the immunomodulatory properties of honeys produced in Kazakhstan, Natural Product Research, 37(6), 996-1001
- Mcloone, P.; Zhumbayeva, A.; Yunussova, S.; Kaliyev, Y.; Yevstafeva, L.; Sungurtas, J.; Verrall, S.; Austin, C.; Allwood, W.; McDougall, G.J. (2021) Identifcation of components in Kazakhstan honeys that correlate with antimicrobial activity against wound and skin infecting microorganisms, BMC Complementary Medicine and Therapies, 21, Art. 300
- Abukhabta, S,; Ghawi, S.K.; Karatzas, K.A.; Charalampopoulos, D.; McDougall, G.; Allwood, J.W.; Verrall, S.; Lavery, S.; Latimer, C.; Pourshahidi, K.; Lawther, R.; O’Connor, G.; Rowland, I.; Gil, C.I.R. (2021) Sulforaphane-enriched extracts from glucoraphanin-rich broccoli exert antimicrobial activity against gut pathogens in vitro and innovative cooking methods increase in vivo intestinal delivery of sulforphane., European Journal of Nutrition, 60, 1263-1276
- Ducreux, L.J.M.; Pont, S.D.A.; Verrall, S.R.; McManus, W.; Hancock, R.D.; Taylor, M.A. (2021) The impact of home storage conditions on the accumulation of acrylamide precursors in potato tubers., Annals of Applied Biology, 178, 304-314
- Petridis, A.; van der Kaay, J.; Sungurtas, J.; Verrall, S.R.; McCallum, S.R.; Graham, J.; Hancock, R.D. (2020) Photosynthetic plasticity allows blueberry (Vaccinium corymbosum L.) plants to compensate for yield loss under conditions of high sink demand., Environmental and Experimental Botany, 174, Article No. 104031.
- Ternan, N.G.; Moore, N.D.; Smyth, D.; McDougall, G.J.; Allwood, J.W.; Verrall, S.; Gill, C.I.R.; Dooley, J.S.G.; McMullan, G. (2018) Increased sporulation underpins adaptation of Clostridium difficile strain 630 to a biologically-relevant faecal environment, with implications for pathogenicity., Scientific Reports, 8, Article No. 16691.
- Jarret, D.A.; Morris, J.; Cullen, D.W.; Gordon, S.L.; Verrall, S.R.; Milne, L.; Hedley, P.E.; Allwood, J.W.; Brennan, R.M.; Hancock, R.D. (2018) A transcript and metabolite atlas of blackcurrant fruit development highlights hormonal regulation and reveals the role of key transcription factors., Frontiers in Plant Science, 9, Article No. 1235.
- Karpinska, B.; Zhang, K.M.; Rasool, B.; Pastok, D.; Morris, J.; Verrall, S.R.; Hedley, P.E.; Hancock, R.D.; Foyer, C.H. (2018) The redox state of the apoplast influences the acclimation of photosynthesis and leaf metabolism to changing irradiance., Plant Cell and Environment, 41, 1083-1097.
- Freitag, S.; Verrall, S.R.; Pont, S.D.A.; McRae, D.; Sungartas, J.A.; Palau, R.; Hawes, C.; Alexander, C.J.; Allwood, J.W.; Foito, A.; Stewart, D.; Shepherd, L.V.T. (2018) Impact of conventional and integrated management systems on the water-soluble vitamin content in potatoes, field beans and cereals., Journal of Agricultural and Food Chemistry, 66, 831-841.
- Rasool, B.; McGowan, J.; Pastok, D.; Marcus, S.E.; Morris, J.A.; Verrall, S.R.; Hedley, P.E.; Hancock, R.D.; Foyer, C.H. (2017) Redox control of aphid resistance through altered cell wall composition and nutritional quality., Plant Physiology, 175, 259-271.
- McDougall, G.J.; Allwood, J.W.; Pereira-Caro, G.; Brown, E.M.; Verrall, S.; Stewart, D.; Latimer, C.; McMullan, G.; Lawther, R.; O’Connor, G.; Rowland, I.; Crozier, A.; Gill, C.I.R. (2017) Novel colon-available triterpenoids identified in raspberry fruits exhibit antigenotoxic activities in vitro., Molecular Nutrition and Food Research, 61, Article No. 1600327.
- McDougall, G.J.; Allwood, J.W.; Pereira-Caro, G.; Brown, E.M.; Ternan, N.; Verrall, S.; Stewart, D.; Lawther, R.; O’Connor, G.; Rowland, I.; Crozier, A.; Gill, C.I.R. (2016) Non-targeted LC-MSn profiling of compounds in ileal fluids that decrease after raspberry intake identifies consistent alterations in bile acid composition., Journal of Natural Products, 79, 2606-2615.
- Stavang, J.A.; Freitag, S.; Foito, A.; Verrall, S.; Heide, O.M.; Stewart, D.; Sonsteby, A. (2015) Raspberry fruit quality changes during ripening and storage as assessed by colour, sensory evaluation and chemical analyses., Scientia Horticulturae, 195, 216-225.
- Comadira, G.; Rasool, B.; Kaprinska, B.; Garcia, B.M.; Morris, J.; Verrall, S.R.; Bayer, M.; Hedley, P.E.; Hancock, R.D.; Foyer, C.H. (2015) WHIRLY1 functions in the control of responses to nitrogen deficiency but not aphid infestation in barley., Plant Physiology, 168, 1140-1151.
- Comadira, G.; Rasool, B.; Karpinska, B.; Morris, J.; Verrall, S.R.; Hedley, P.E.; Foyer, C.H.; Hancock, R.D. (2015) Nitrogen deficiency in barley (Hordeum vulgare) seedlings induces molecular and metabolic adjustments that trigger aphid resistance., Journal of Experimental Botany, 66, 3639-3655.
- Shepherd, L.V.T.; Alexander, C.J.; Hackett, C.A.; McRae, D.; Sungurtas, J.A.; Verrall, S.R.; Morris, J.A.; Hedley, P.E.; Rockhold, D.; Belknap, W.; Davies, H.V. (2015) Impacts on the metabolome of down-regulating polyphenol oxidase in potato tubers., Transgenic Research, 24, 447-461.
- Foyer, C.H.; Verrall, S.R.; Hancock, R.D. (2015) Systematic analysis of phloem-feeding insect induced transcriptional reprogramming in Arabidopsis highlights common features and reveals distinct responses to specialist and generalist insects., Journal of Experimental Botany, 66, 495-512.
- Vagiri, M.; Conner, S.; Stewart, D.; Andersson, S.C.; Verrall, S.; Johansson, E.; Rumpunen, K. (2015) Phenolic compounds in blackcurrant (Ribes nigrum L.) leaves relative to leaf position and harvest date., Food Chemistry, 172, 135-142.
- Mazur, S.P.; Sonsteby, A.; Wold, A.B.; Foito, A.; Freitag, S.; Verrall, S.; Conner, S.; Stewart, D.; Heide, O.M. (2014) Post-flowering photoperiod has marked effects on fruit chemical composition in red raspberry (Rubus idaeus)., Annals of Applied Biology, 165, 454-465.
- Mazur, S.P.; Sonsteby, A.; Nes, A.; Wold, A.B.; Foito, A.; Freitag, S.; Verrall, S.R.; Stewart, D.; Heide, O.M. (2014) Effects of Post-Flowering Environmental Variation along an Altitudinal Gradient on Chemical Composition of ‘Glen Ample’ Red Raspberry (Rubus idaeus L.)., European Journal of Horticultural Science, 79, 267-277.
- McDougall, G.J.; Conner, S.; Pereira-Caro, G.; Gonzalez-Barrio, R.; Brown, E.M.; Verrall, S.; Stewart, D.; Moffet, T.; Ibars, M.; Lawther, R.; O’Connor, G.; Rowland, I.; Crozier, A.; Gill, C.I.R. (2014) Tracking (poly)phenol components from raspberries in ileal fluid., Journal of Agricultural and Food Chemistry, 62, 7631-7641.
- Cognat, C.; Shepherd, T.; Verrall, S.R.; Stewart, D. (2014) Relationship between volative profile and sensory development of an oat based biscuit., Food Chemistry, 160, 72-81.
- Morris, W.L.; Hancock, R.D.; Ducreux, L.J.M.; Morris, J.A.; Usman, M.; Verrall, S.R.; Sharma, S.K.; Bryan, G.J.; McNicol, J.W.; Hedley, P.E.; Taylor, M.A. (2014) Day length dependent restructuring of the leaf transcriptome and metabolome in potato genotypes with contrasting tuberisation phenotypes., Plant Cell and Environment, 37, 1351-1363.
- Kerchev, P.I.; Karpinska, B.; Morris, J.A.; Hussain, A.; Verrall, S.R.; Hedley, P.E.; Fenton, B.; Foyer, C.H.; Hancock, R.D. (2013) Vitamin C and the abscisic acid-insensitive 4 transcription factor are important determinants of aphid resistance in arabidopsis., Antioxidants and Redox Signalling, 18, 2091-2105.
- Josuttis, M.; Verrall, S.R.; Stewart, D.; Kruger, E.; McDougall, G.J. (2013) Genetic and environmental effects on tannin composition in strawberry (Fragaria x ananassa) cultivars grown in different European locations., Journal of Agricultural and Food Chemistry, 61, 790-800.
- Cognat, C.; Shepherd, T.; Verrall, S.R.; Stewart, D. (2012) Comparison of two headspace sampling techniques for the analysis of off-flavour volatiles from oat based products., Food Chemistry, 134, 1592-1600.
- Nwankno, A.J.; Gordon, S.L.; Verrall, S.R.; Brennan, R.M.; Hancock, R.D. (2012) Treatment with fungicides influences phytochemical quality of blackcurrant juice., Annals of Applied Biology, 160, 86-96.
- Ross, H.A.; Morris, W.L.; Ducreux, L.J.M.; Hancock, R.D.; Verrall, S.R.; Morris, J.A.; Tucker, G.A.; Stewart, D.; Hedley, P.E.; McDougall, G.J.; Taylor, M.A. (2011) Pectin engineering to modify product quality in potato., Plant Biotechnology Journal, 9, 848-856.
Books / chapters
- Dobson, G.; Shepherd, T.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; McNicol, J.W.; Stewart, D.; Davies, H.V. (2007) Application of metabolite and flavour volatile profiling to studies of biodiversity in Solanum species., In: Nikolau, B.L. & Wurtele, E.S. (eds.). Concepts in Plant Metabolomics. Springer, Dordrecht, 259-268. ISBN: 978-1-4020-5607-9
- Shepherd, T.; Dobson, G.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; Stewart, D.; Davies, H.V. (2007) Profiling of metabolites and volatile flavour compounds from Solanum species using gas chromatography-mass spectrometry., In: Nikolau, B.L. & Wurtele, E.S. (eds.). Concepts in Plant Metabolomics. Springer, Dordrecht, 208-219. ISBN: 978-1-4020-5607-9
Technical / contract reports
- Ross, H.A.; Morris, W.L.; Ducreux, L.J.M.; Hancock, R.D.; Verrall, S.R.; Morris, J.A.; Stewart, D.; Hedley, P.E.; McDougall, G.J.; Taylor, M.A. (2011) The role of pectin methyl esterase in determining potato tuber textural quality., Annual Report of the Scottish Crop Research Institute for 2010, pp32-33.
- McNicol, J.W.; Verrall, S.R.; Shepherd, T.; Dobson, G.; Griffiths, D.W.; Ramsay, G.; Davies, H.V.; Stewart, D. (2006) Statistical analysis of metabolomic data., Annual Report of the Scottish Crop Research Institute for 2006, pp54-55.
Conference papers
- Brooker, R.; Hewison, R.; Mitchell, C.; Newton, A.; Neilson, R.; Pakeman, R.; Raubach, S.; Shaw, P.; Verrall, S.; Karley, A. (2023) Crop mixtures as part of the sustainability toolbox for the distilling industry, World Distilled Spirits Conference, 9 May 2023, EICC, Edinburgh.
- Zhang, K.; Rasool, B.; Pastok, D.; Morris, J.; Verrall, S.R.; Hedley, P.E.; Hancock, R.D.; Foyer, C.H. (2016) The redox state of the apoplast influences acclimation to changing irradiance in tobacco (Nicotiana tobaccum)., Enhancing Photosynthesis in Crop Plants: Targets for Improvement, Discussion Meeting, Royal Society, London, 10-11 October 2016.
- Shepherd, L.V.T.; Pont, S.D.A.; Bryan, G.J.; Dale, M.F.B.; Hancock, R.D.; Hedley, P.E.; Morris, J.A.; Verrall, S.R.; Hackett, C.A.; McNicol, J.W.; Davies, H.V. (2013) Acrylamide forming potential of potato: predictive tools and genetic interactions., Aspects of Applied Biology, 116, 53-60.
- Hancock, R.D.; Jarret, D.; Morris, J.; Jorgensen L.; Verrall, S.R.; Hedley, P.E.; Brennan, R.M. (2013) Developing a transcriptomic and metabolomic map of blackcurrant fruit development for the identification of key genes associated with quality traits., UK PlantSci 2013, University of Dundee, Dundee, 16-17 April 2013.
- Jarret, D.; Rowbottom, S.; Morris, J.; Jorgensen, L.; Verrall, S.R.; Hedley, P.E.; Brennan, R.M.; Hancock, R.D. (2013) Comparative transcriptome and metabolome analysis of developing blackcurrant seed provides an insight into pathway-specific gene-metabolite co-expression., Aspects of Applied Biology 119, 2013 Fruit and Roots: A celebration and forward look, East Malling Research, 6-7 November 2013.
- Shepherd, T.; Dobson, G.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; McNicol, J.W.; Davies, H.V.; Stewart, D. (2006) Use and limitations of GC-MS based metabolite profiling methods for the analysis of metabolite content in freeze-dried potato tubers., 4th International Plant Metabolomics Conference, Reading, 7-10 April 2007. Metabolomics, 2(4), p279.
- Stewart, D.; Davies, H.V.; Verrall, S.R.; Shepherd, T.; Dobson, G.; Marshall, R.; Colquhoun, I.; Le Gall, G. (2004) Metabolic profiling: Platform technologies to detect unintended effects following genetic modification of potato (Solanum tuberosum)., 3rd International Congress on Plant Metabolomics, Iowa, USA, 3-6 June 2004.
- Dobson, G.; Shepherd, T.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; McNicol, J.W.; Stewart, D.; Davies, H.V. (2004) Application of metabolite and flavour volatile profiling to studies of biodiversity in Solanum species., 3rd International Congress on Plant Metabolomics, Iowa, USA, 3-6 June 2004.
- Shepherd, T.; Dobson, G.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; Stewart, D.; Davies, H.V. (2004) Profiling of metabolites and volatile flavour compounds from Solanum species using gas chromatography-mass spectrometry., 3rd International Congress on Plant Metabolomics, Iowa, USA, 3-6 June 2004.
- Shepherd, T.; Dobson, G.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; McNicol, J.W.; Stewart, D.; Davies, H.V. (2004) Application of metabolite profiling to studies of biodiversity in Solanum species., Society for Experimental Biology Annual Meetin,. Heriot-Watt Unviersity, 29 March – 2 April 2004.
- Shepherd, T.; Dobson, G.; Marshall, R.; Verrall, S.R.; Conner, S.; Shepherd, L.V.T.; McNicol, J.W.; Deighton, N.; Stewart, D.; Davies, H.V. (2003) Can metabolite profiling be used to identify unintended effects in transgenic tubers?, 16th International Mass Spectrometry Conference, Edinburgh, 31 August – 5 September 2003.
- Squires, J.N.; Daniell, T.J.; Clegg, C.D.; Griffiths, B.S.; Ritz, K.; Verrall, S.R.; Wheatley, R.E. (2001) Effects of plants on diversity of nitrite-reducing bacteria in an upland grassland., Molecular Microbial Ecology Group, York.
- Daniell, T.J.; Clegg, C.D.; Griffiths, B.S.; Ritz, K.; Squires, J.; Verrall, S.R.; Wheatley, R.E. (2001) Coupling between plants and diversity of nitrite-reducing bacteria in an upland pasture., Interactions in the Microbial World: 9th International Symposium on Microbial Ecology, Amsterdam, 26-31 August 2001.
- Bruce, A.; Wheatley, R.E.; Verrall, S.R. (2000) Effect of volatiles from bacteria and yeast on the growth and pigmentation of sap-stain fungi., Proceedings of 31st Meeting of International Research Group on Wood Preservation, Hawaii, 14-19 May 2000.
Conference posters / abstracts
- Dobson, G.; Shepherd, T.; Allwood, W.; Palau, R.; McRae, D.; Pont, S.; Sungurtas, J.; Alexander, C.; Verrall, S.; Stewart, D.; Shepherd, L. (2017) Comparison of rapeseed grown sustainably and conventionally. A comparison of the quality of oil and meal from winter oilseed rape grown under sustainable and conventional practices., International Conference on Natural Product Biotechnology, AECC, Aberdeen, 25-26 September 2017.
- Dobson, G.; Shepherd, T.; Palau, R.; McRae, D.; Pont , S.; Sungurtus, J.; Alexander, C.; Verrall, S.; Stewart, D.; Shepherd, L. (2017) A comparison of the quality of oil and meal from rapeseed grown under sustainable and conventional cultivation practices., Scottish Lipid Discussion Group, University of St Andrews, 4 September 2017.
- Shepherd, T.; Dobson, G.; McRae, D.; Sungurtas, J.; Pont, S.; Palau, R.; Alexander, C.; Verrall, S.; Stewart, D.; Shepherd, L. (2016) Comparing the effects of different cultivation practices on the metabolite composition of cereal crops., Cereals in Practice, Saphock Farm, Oldmeldrum, 5 July 2016. (Poster).
- Dobson, G.; Shepherd, T.; Palau, R.; McRae, D.; Sungurtas, J.; Alexander, C.; Verrall, S.; Stewart, D.; Shepherd, L.V.T. (2016) Comparison of rapeseed grown sustainably and conventionally. A comparison of the quality of oil and meal from winter oilseed rape grown under sustainable and conventional cultivation practices., Agriculture and the Environment XI, What Future for our Farming Systems?: Environmental Challenges and Integrated Solutions. Edinburgh, 1-2 March 2016. (Poster).
- Shepherd, T.; Dobson, G.; McRae, D.; Sungurtas, J.; Pont, S.; Palau, R.; Alexander, C.; Verrall, S.; Stewart, D.; Shepherd, L.V.T. (2016) A comparison of the metabolite compositions of spring barley, winter barley and winter wheat grown under sustainable and conventional cultivation practices using a GC-MS metabolomics approach., Agriculture and the Environment XI, What Future for our Farming Systems?: Environmental Challenges and Integrated Solutions. Edinburgh, 1-2 March 2016. (Poster).
- Shepherd, T.; Dobson, G.; McRae, D.; Sungurtas, J.; Pont, S.; Palau, R.; Alexander, C.; Verrall, S.; Stewart, D.; Shepherd, L. (2016) Comparing the effects of different cultivation practices on the metabolite composition of cereal crops., Scottish Metabolomics Network Meeting at the Centre for Health Sciences, Inverness, 16-17 November 2016.
- Hancock, R.D.; Morris, W.L.; Ducreux, L.J.M.; Morris, J.; Usman, M.; Verrall, S.R.; Hedley, P.E.; Taylor, M.A. (2013) High temperature inhibition of potato tuberisation is associated with altered redox status and associated transcript pro¿les., UK Plant Science Conference, West Park Centre, Dundee, 16-17 April 2013. (Poster)
- Morris, W.L.; Ducreux, L.; Usman, M.; Hedley, P.; Verrall, S.; Zhang, R.; Morris, J.; Hancock, R.D. (2013) A physiological, biochemical and transcriptomic approach to understanding the response of potato to elevated temperature., UK Plant Science Conference, West Park Centre, Dundee, 16-17 April 2013. (Poster)
- Ross, H.A.; Gordon, S.; McDougall, G.J.; Verrall, S.R.; Wright, K.M.; Cross, J.V.; Berrie, A.; Xu, X.; Brennan, R.M. (2011) Exploring variation in textural properties in blackcurrant germplasm., Xth International Rubus and Ribes Conference, Zlatibor, Serbia, 22-26 June 2011. (Poster)
- Abreu, I.N.; Kanichukattu, E.N.; Sungurtas, J.; Verrall, S.R.; Stewart, D. (2010) Metabolomics as a route to fruit flavour and functionality: blackcurrant as a model study., 28th International Horticultural Congress, Lisbon, Portugal, 22-27 August 2010 (Poster and Talk).
- Verrall, S.R.; McNicol, J.W.; Shepherd, T.; Dobson, G.; Griffiths, D.W.; Ramsay, G.; Stewart, D. (2007) Using hierarchical clustering of metabolomic data to relate clusters to metabolite pathways., 3rd International Metabolomics Society Conference, Manchester, 10-14 June 2007.
- Dobson, G.; Shepherd, T.; Griffiths, D.W.; Ross, H.A.; Verrall, S.R.; Stewart, D. (2007) Studies of tuber developmental stages in the potato Solanum tuberosum group phureja using GC-MS-based metabolomics and volatile analysis approaches., 3rd International Metabolomics Conference. Manchester, 10-14 June 2007.
- Shepherd, T.; Dobson, G.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; Stewart, D.; Davies, H.V. (2004) Use of gas chromatography-(time-of-flight) mass spectrometry for analysis of metabolites from Solanum species., Society for Experimental Biology Annual Meeting, Heriot Watt University, 29 March – 2 April 2004.
- Verrall, S.R.; Deighton, N.; Marshall, R.; Sungurtas, J.; Shepherd, T.; Shepherd, L.V.T.; Dobson, G.; McNicol, J.W.; Davies, H.V. (2003) Can metabolomics identify unintended effects in transgenic tubers?, 2nd International Conference on Plant Metabolomics, Potsdam, Germany, 25-28 April 2003. (Poster)
- Shepherd, T.; Dobson, G.; Marshall, R.; Verrall, S.R.; Conner, S.; Griffiths, D.W.; Stewart, D.; Davies, H.V. (2003) Analysis of metabolites from Solanum species using gas chromatography-(Time-of-Flight) mass spectrometry and automated data analysis., 16th International Mass Spectrometry Conference, Edinburgh, 31 August – 5 September 2003. (Poster)