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Goodacre, Royston ORCID: 0000-0003-2230-645X (2020) The 2020 metabolomics publication awards. METABOLOMICS, 16 (5). 55-.

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Allwood, J William, Woznicki, Tomasz L, Xu, Yun ORCID: 0000-0003-3228-5111, Foito, Alexandre, Aaby, Kjersti, Sungurtas, Julie, Freitag, Sabine, Goodacre, Royston ORCID: 0000-0003-2230-645X, Stewart, Derek, Remberg, Siv F et al (show 2 more authors) , Heide, Ola M and Sonsteby, Anita (2019) Application of HPLC-PDA-MS metabolite profiling to investigate the effect of growth temperature and day length on blackcurrant fruit. METABOLOMICS, 15 (1). 12-.

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Allwood, J William, Martinez-Martin, Pilar, Xu, Yun ORCID: 0000-0003-3228-5111, Cowan, Alexander, Pont, Simon, Griffiths, Irene, Sungurtas, Julie, Clarke, Sarah, Goodacre, Royston ORCID: 0000-0003-2230-645X, Marshall, Athole et al (show 2 more authors) , Stewart, Derek and Howarth, Catherine (2021) Assessing the impact of nitrogen supplementation in oats across multiple growth locations and years with targeted phenotyping and high-resolution metabolite profiling approaches. FOOD CHEMISTRY, 355. 129585-.

Basson, Rubinder, Lima, Cassio, Muhamadali, Howbeer, Li, Weiping, Hollywood, Katherine, Li, Ludanni, Baguneid, Mohamed, Al Kredly, Rawya, Goodacre, Royston ORCID: 0000-0003-2230-645X and Bayat, Ardeshir (2020) Assessment of transdermal delivery of topical compounds in skin scarring using a novel combined approach of Raman spectroscopy and HPLC. Adv Wound Care (New Rochelle), 10 (1). pp. 1-12.

Charles, Elia D, Muhamadali, Howbeer, Goodacre, Royston ORCID: 0000-0003-2230-645X and Pittman, Jon K (2019) Biochemical signatures of acclimation by <i>Chlamydomonas reinhardtii </i>to different ionic stresses. ALGAL RESEARCH-BIOMASS BIOFUELS AND BIOPRODUCTS, 37. pp. 83-91.

Ahmed, Waqar, White, Iain R, Wilkinson, Maxim, Johnson, Craig F, Rattray, Nicholas, Kishore, Amit K, Goodacre, Royston ORCID: 0000-0003-2230-645X, Smith, Craig J and Fowler, Stephen J (2021) Breath and plasma metabolomics to assess inflammation in acute stroke. SCIENTIFIC REPORTS, 11 (1). 21949-.

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Mori, Kentaro, Beauvoit, Bertrand P, Biais, Benoit, Chabane, Maxime, Allwood, J William, Deborde, Catherine, Maucourt, Mickael, Goodacre, Royston ORCID: 0000-0003-2230-645X, Cabasson, Cecile, Moing, Annick et al (show 2 more authors) , Rolin, Dominique and Gibon, Yves (2019) Central Metabolism Is Tuned to the Availability of Oxygen in Developing Melon Fruit. FRONTIERS IN PLANT SCIENCE, 10. 594-.

Wilkinson, Maxim, Maidstone, Robert, Loudon, Andrew, Blaikley, John, White, Iain R, Singh, Dave, Ray, David W, Goodacre, Royston ORCID: 0000-0003-2230-645X, Fowler, Stephen J and Durrington, Hannah J (2019) Circadian rhythm of exhaled biomarkers in health and asthma. EUROPEAN RESPIRATORY JOURNAL, 54 (4). 1901068-.

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Guo, Shuxia, Beleites, Claudia, Neugebauer, Ute, Abalde-Cela, Sara, Afseth, Nils Kristian, Alsamad, Fatima, Anand, Suresh, Araujo-Andrade, Cuauhtemoc, Askrabic, Sonja, Avci, Ertug et al (show 76 more authors) , Baia, Monica, Baranska, Malgorzata, Baria, Enrico, Batista de Carvalho, Luis AE, de Bettignies, Philippe, Bonifacio, Alois, Bonnier, Franck, Brauchle, Eva Maria, Byrne, Hugh J, Chourpa, Igor, Cicchi, Riccardo, Cuisinier, Frederic, Culha, Mustafa, Dahms, Marcel, David, Catalina, Duponchel, Ludovic, Duraipandian, Shiyamala, El-Mashtoly, Samir F, Ellis, David I, Eppe, Gauthier, Falgayrac, Guillaume, Gamulin, Ozren, Gardner, Benjamin, Gardner, Peter, Gerwert, Klaus, Giamarellos-Bourboulis, Evangelos J, Gizurarson, Sveinbjorn, Gnyba, Marcin, Goodacre, Royston ORCID: 0000-0003-2230-645X, Grysan, Patrick, Guntinas-Lichius, Orlando, Helgadottir, Helga, Grosev, Vlasta Mohacek, Kendall, Catherine, Kiselev, Roman, Kolbach, Micha, Krafft, Christoph, Krishnamoorthy, Sivashankar, Kubryck, Patrick, Lendl, Bernhard, Loza-Alvarez, Pablo, Lyng, Fiona M, Machill, Susanne, Malherbe, Cedric, Marro, Monica, Marques, Maria Paula M, Matuszyk, Ewelina, Morasso, Carlo Francesco, Moreau, Myriam, Muhamadali, Howbeer, Mussi, Valentina, Notingher, Ioan, Pacia, Marta Z, Pavone, Francesco S, Penel, Guillaume, Petersen, Dennis, Piot, Olivier, Rau, Julietta V, Richter, Marc, Rybarczyk, Maria Krystyna, Salehi, Hamideh, Schenke-Layland, Katja, Schluecker, Sebastian, Schosserer, Markus, Schuetze, Karin, Sergo, Valter, Sinjab, Faris, Smulko, Janusz, Sockalingum, Ganesh D, Stiebing, Clara, Stone, Nick, Untereiner, Valerie, Vanna, Renzo, Wieland, Karin, Popp, Juergen and Bocklitz, Thomas (2020) Comparability of Raman Spectroscopic Configurations: A Large Scale Cross-Laboratory Study. ANALYTICAL CHEMISTRY, 92 (24). pp. 15745-15756.

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Moing, Annick, Allwood, J William, Aharoni, Asaph, Baker, John, Beale, Michael H, Ben-Dor, Shifra, Biais, Benoit, Brigante, Federico, Burger, Yosef, Deborde, Catherine et al (show 26 more authors) , Erban, Alexander, Faigenboim, Adi, Gur, Amit, Goodacre, Royston ORCID: 0000-0003-2230-645X, Hansen, Thomas H, Jacob, Daniel, Katzir, Nurit, Kopka, Joachim, Lewinsohn, Efraim, Maucourt, Mickael, Meir, Sagit, Miller, Sonia, Mumm, Roland, Oren, Elad, Paris, Harry S, Rogachev, Ilana, Rolin, Dominique, Saar, Uzi, Schjoerring, Jan K, Tadmor, Yaakov, Tzuri, Galil, de Vos, Ric CH, Ward, Jane L, Yeselson, Elena, Hall, Robert D and Schaffer, Arthur A (2020) Comparative Metabolomics and Molecular Phylogenetics of Melon (<i>Cucumis melo</i>, Cucurbitaceae) Biodiversity. METABOLITES, 10 (3). E121-.

Williams, Alex, Langridge, Holly, Straathof, Angela L, Fox, Graeme, Muhammadali, Howbeer, Hollywood, Katherine A, Xu, Yun ORCID: 0000-0003-3228-5111, Goodacre, Royston ORCID: 0000-0003-2230-645X and de Vries, Franciska T (2021) Comparing root exudate collection techniques: An improved hybrid method. SOIL BIOLOGY & BIOCHEMISTRY, 161. 108391-.

Albóniga, Oihane E, González, Oskar, Alonso, Rosa M, Xu, Yun ORCID: 0000-0003-3228-5111 and Goodacre, Royston ORCID: 0000-0003-2230-645X (2020) Comparison of liver and plasma metabolic profiles in piglets of different ages as animal models for paediatric population. The Analyst, 145 (21). pp. 6859-6867.

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Broeckling, Corey D, Beger, Richard D, Cheng, Leo L, Cumeras, Raquel, Cuthbertson, Daniel J, Dasari, Surendra, Davis, W Clay, Dunn, Warwick B ORCID: 0000-0001-6924-0027, Evans, Anne Marie, Fernández-Ochoa, Alvaro et al (show 20 more authors) , Gika, Helen, Goodacre, Royston ORCID: 0000-0003-2230-645X, Goodman, Kelli D, Gouveia, Goncalo J, Hsu, Ping-Ching, Kirwan, Jennifer A, Kodra, Dritan, Kuligowski, Julia, Lan, Renny Shang-Lun, Monge, María Eugenia, Moussa, Laura W, Nair, Sindhu G, Reisdorph, Nichole, Sherrod, Stacy D, Ulmer Holland, Candice, Vuckovic, Dajana, Yu, Li-Rong, Zhang, Bo, Theodoridis, Georgios and Mosley, Jonathan D (2023) Current Practices in LC-MS Untargeted Metabolomics: A Scoping Review on the Use of Pooled Quality Control Samples. Analytical chemistry, 95 (51). pp. 18645-18654.

van Oort, Pouline MP, White, Iain R, Ahmed, Waqar, Johnson, Craig, Bannard-Smith, Jonathan, Felton, Timothy, Bos, Lieuwe D, Goodacre, Royston ORCID: 0000-0003-2230-645X, Dark, Paul and Fowler, Stephen J (2020) Detection and quantification of exhaled volatile organic compounds in mechanically ventilated patients - comparison of two sampling methods. The Analyst, 146 (1). pp. 222-231.

Richardson, Paul IC, Muhamadali, Howbeer, Lei, Yang, Golovanov, Alexander P, Ellis, David I and Goodacre, Royston ORCID: 0000-0003-2230-645X (2019) Detection of the adulteration of fresh coconut water via NMR spectroscopy and chemometrics. ANALYST, 144 (4). pp. 1401-1408.

Ahmed, Waqar M, Steenwelle, Ruud JA, Knobel, Hugo H, Davie, Alan, Steijvers, Ron, Verhoeckx, Fred, Goodacre, Royston ORCID: 0000-0003-2230-645X, Fowler, Stephen J, Rijnders, AJHM and Nijsen, Tamara M (2020) Development of a sensor device with polymer-coated piezoelectric micro-cantilevers for detection of volatile organic compounds. Measurement Science and Technology, 31 (3). 035103-035103.

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Trivedi, Drupad K, Sinclair, Eleanor, Xu, Yun ORCID: 0000-0003-3228-5111, Sarkar, Depanjan, Walton-Doyle, Caitlin, Liscio, Camilla, Banks, Phine, Milne, Joy, Silverdale, Monty, Kunath, Tilo et al (show 2 more authors) , Goodacre, Royston ORCID: 0000-0003-2230-645X and Barran, Perdita (2019) Discovery of Volatile Biomarkers of Parkinson's Disease from Sebum. ACS CENTRAL SCIENCE, 5 (4). pp. 599-606.

AlMasoud, Najla, Muhamadali, Howbeer, Chisanga, Malama ORCID: 0000-0002-1481-1299, AlRabiah, Haitham, Lima, Cassio A and Goodacre, Royston ORCID: 0000-0003-2230-645X (2021) Discrimination of bacteria using whole organism fingerprinting: the utility of modern physicochemical techniques for bacterial typing. ANALYST, 146 (3). pp. 770-788.

Wilkinson, Maxim, White, Iain R, Goodacre, Royston ORCID: 0000-0003-2230-645X, Nijsen, Tamara ME and Fowler, Stephen J (2020) Effects of high relative humidity and dry purging on VOCs obtained during breath sampling on common sorbent tubes. Journal of Breath Research: volatiles for medical diagnosis, 14 (4). 046006-.

Theodoridis, Georgios, Gika, Helen, Raftery, Daniel, Goodacre, Royston ORCID: 0000-0003-2230-645X, Plumb, Robert S and Wilson, Ian D ORCID: 0000-0002-8558-7394 (2023) Ensuring Fact-Based Metabolite Identification in Liquid Chromatography-Mass Spectrometry-Based Metabolomics. ANALYTICAL CHEMISTRY, 95 (8). pp. 3909-3916.

Muhamadali, Howbeer, Simoens, Kenneth, Xu, Yun ORCID: 0000-0003-3228-5111, Nicolai, Bart, Bernaerts, Kristel and Goodacre, Royston ORCID: 0000-0003-2230-645X (2020) Evaluation of Sample Preparation Methods for Inter-Laboratory Metabolomics Investigation of <i>Streptomyces lividans</i> TK24. METABOLITES, 10 (9). E379-.

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van Oort, Pouline M, Brinkman, Paul, Slingers, Gitte, Koppen, Gudrun, Maas, Adrie, Roelofs, Joris J, Schnabel, Ronny, Bergmans, Dennis C, Raes, M, Goodacre, Royston ORCID: 0000-0003-2230-645X et al (show 3 more authors) , Fowler, Stephen J, Schultz, Marcus J and Bos, Lieuwe D (2019) Exhaled breath metabolomics reveals a pathogen-specific response in a rat pneumonia model for two human pathogenic bacteria: a proof-of-concept study. American journal of physiology. Lung cellular and molecular physiology, 316 (5). L751-L756.

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Akbali, Baris ORCID: 0000-0002-6852-2193, Boisdon, Cedric, Smith, Barry ORCID: 0000-0001-5571-3647, Chaisrikhwun, Boonphop, Wongravee, Kanet, Vilaivan, Tirayut, Lima, Cássio ORCID: 0000-0002-9062-6298, Huang, Chen-Han, Chen, Tsan-Yao, Goodacre, Royston ORCID: 0000-0003-2230-645X et al (show 1 more authors) and Maher, Simon (2023) Focusing Ion Funnel-assisted Ambient Electrospray enables High-Density and Uniform Deposition of Non-spherical Gold Nanoparticles for Highly Sensitive Surface-enhanced Raman Scattering. The Analyst, 148 (19). pp. 4677-4687.

Qu, Bingjie, Wu, Shiqiang, Zhao, Peng, Ma, Zheng Feei, Goodacre, Royston ORCID: 0000-0003-2230-645X, Yuan, Linxi and Chen, Ying (2023) Geographical pattern of minerals and its association with health disparities in the USA. Environmental geochemistry and health, 45 (7). pp. 4407-4424.

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Uawisetwathana, Umaporn, Chevallier, Olivier P, Xu, Yun ORCID: 0000-0003-3228-5111, Kamolsukyeunyong, Wintai, Nookaew, Intawat, Somboon, Thapakorn, Toojinda, Theerayut, Vanavichit, Apichart, Goodacre, Royston ORCID: 0000-0003-2230-645X, Elliott, Christopher T et al (show 1 more authors) and Karoonuthaisiri, Nitsara (2019) Global metabolite profiles of rice brown planthopper-resistant traits reveal potential secondary metabolites for both constitutive and inducible defenses. METABOLOMICS, 15 (12). 151-.

Broadhurst, David, Goodacre, Royston ORCID: 0000-0003-2230-645X, Reinke, Stacey N, Kuligowski, Julia, Wilson, Ian D ORCID: 0000-0002-8558-7394, Lewis, Matthew R and Dunn, Warwick B ORCID: 0000-0001-6924-0027 (2018) Guidelines and considerations for the use of system suitability and quality control samples in mass spectrometry assays applied in untargeted clinical metabolomic studies. METABOLOMICS, 14 (6). 72-.

Lima, Cassio, Muhamadali, Howbeer, Xu, Yun ORCID: 0000-0003-3228-5111, Kansiz, Mustafa and Goodacre, Royston ORCID: 0000-0003-2230-645X (2021) Imaging Isotopically Labeled Bacteria at the Single-Cell Level Using High-Resolution Optical Infrared Photothermal Spectroscopy. Analytical chemistry, 93 (6). pp. 3082-3088.

Theakstone, Ashton G, Brennan, Paul M, Jenkinson, Michael D ORCID: 0000-0003-4587-2139, Goodacre, Royston ORCID: 0000-0003-2230-645X and Baker, Matthew J (2023) Investigating centrifugal filtration of serum-based FTIR spectroscopy for the stratification of brain tumours. PloS one, 18 (2). e0279669-e0279669.

Tengsuttiwat, Thanyaporn, Kaderbhai, Naheed Nazly, Gallagher, Joe, Goodacre, Royston ORCID: 0000-0003-2230-645X and Muhamadali, Howbeer (2022) Metabolic Fingerprint Analysis of Cytochrome <i>b</i>₅-producing <i>E. coli</i> N4830-1 Using FT-IR Spectroscopy. FRONTIERS IN MICROBIOLOGY, 13. 874247-.

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Rattray, Nicholas JW, Trivedi, Drupad K, Xu, Yun ORCID: 0000-0003-3228-5111, Chandola, Tarani, Johnson, Caroline H, Marshall, Alan D, Mekli, Krisztina, Rattray, Zahra, Tampubolon, Gindo, Vanhoutte, Bram ORCID: 0000-0002-8032-9214 et al (show 5 more authors) , White, Iain R, Wu, Frederick CW, Pendleton, Neil, Nazroo, James and Goodacre, Royston ORCID: 0000-0003-2230-645X (2019) Metabolic dysregulation in vitamin E and carnitine shuttle energy mechanisms associate with human frailty. NATURE COMMUNICATIONS, 10 (1). 5027-.

Chisanga, Malama ORCID: 0000-0002-1481-1299, Muhamadali, Howbeer, Mcdougall, Danielle, Xu, Yun ORCID: 0000-0003-3228-5111, Lockyer, Nicholas and Goodacre, Royston ORCID: 0000-0003-2230-645X (2021) Metabolism in action: stable isotope probing using vibrational spectroscopy and SIMS reveals kinetic and metabolic flux of key substrates. The Analyst, 146 (5). pp. 1734-1746.

Valle, Antonio, Soto, Zamira, Muhamadali, Howbeer, Hollywood, Katherine A, Xu, Yun ORCID: 0000-0003-3228-5111, Lloyd, Jonathan R, Goodacre, Royston ORCID: 0000-0003-2230-645X, Cantero, Domingo, Cabrera, Gema and Bolivar, Jorge (2022) Metabolomics for the design of new metabolic engineering strategies for improving aerobic succinic acid production in <i>Escherichia coli</i>. METABOLOMICS, 18 (8). 56-.

Valle, Antonio, de la Calle, Maria Elena, Muhamadali, Howbeer, Hollywood, Katherine A, Xu, Yun ORCID: 0000-0003-3228-5111, Lloyd, Jonathan R, Goodacre, Royston ORCID: 0000-0003-2230-645X, Cantero, Domingo and Bolivar, Jorge (2023) Metabolomics of <i>Escherichia coli</i> for Disclosing Novel Metabolic Engineering Strategies for Enhancing Hydrogen and Ethanol Production. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 24 (14). 11619-.

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Sinclair, Eleanor, Trivedi, Drupad K, Sarkar, Depanjan, Walton-Doyle, Caitlin, Milne, Joy, Kunath, Tilo, Rijs, Anouk M, de Bie, Rob MA, Goodacre, Royston ORCID: 0000-0003-2230-645X, Silverdale, Monty et al (show 1 more authors) and Barran, Perdita (2021) Metabolomics of sebum reveals lipid dysregulation in Parkinson's disease. NATURE COMMUNICATIONS, 12 (1). 1592-.

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Ahmed, Waqar M, Brinkman, Paul, Weda, Hans, Knobel, Hugo H, Xu, Yun ORCID: 0000-0003-3228-5111, Nijsen, Tamara M, Goodacre, Royston ORCID: 0000-0003-2230-645X, Rattray, Nicholas, Vink, Teunis J, Santonico, Marco et al (show 5 more authors) , Pennazza, Giorgio, Montuschi, Paolo, Sterk, Peter J, Fowler, Stephen J and Grp, U-BIOPRED Study (2019) Methodological considerations for large-scale breath analysis studies: lessons from the U-BIOPRED severe asthma project. JOURNAL OF BREATH RESEARCH, 13 (1). 016001-.

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Ahmed, Waqar M, Fenn, Dominic, White, Iain R, Dixon, Breanna, Nijsen, Tamara ME, Knobel, Hugo H, Brinkman, Paul, Van Oort, Pouline MP, Schultz, Marcus J, Dark, Paul et al (show 5 more authors) , Goodacre, Royston ORCID: 0000-0003-2230-645X, Felton, Timothy, Bos, Lieuwe DJ, Fowler, Stephen J and BreathDx Consortium, (2022) Microbial volatiles as diagnostic biomarkers of bacterial lung infection in mechanically ventilated patients. Clinical infectious diseases : an official publication of the Infectious Diseases Society of America, 76 (6). ciac859-ciac859.

Lima, Cassio ORCID: 0000-0002-9062-6298, Muhamadali, Howbeer and Goodacre, Royston ORCID: 0000-0003-2230-645X (2023) Monitoring Phenotype Heterogeneity at the Single-Cell Level within <i>Bacillus</i> Populations Producing Poly-3-hydroxybutyrate by Label-Free Super-resolution Infrared Imaging. Analytical chemistry, 95 (48). pp. 17733-17740.

Caixeta, Douglas Carvalho, Lima, Cassio ORCID: 0000-0002-9062-6298, Xu, Yun ORCID: 0000-0003-3228-5111, Guevara-Vega, Marco, Espindola, Foued Salmen, Goodacre, Royston ORCID: 0000-0003-2230-645X, Zezell, Denise Maria and Sabino-Silva, Robinson (2023) Monitoring glucose levels in urine using FTIR spectroscopy combined with univariate and multivariate statistical methods. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 290. 122259-.

Goodacre, Royston ORCID: 0000-0003-2230-645X (2019) NEWS: the 2019 Metabolomics publication awards. METABOLOMICS, 15 (5). 66-.

Goodacre, Royston ORCID: 0000-0003-2230-645X (2023) NEWS: the 2023 <i>Metabolomics</i> publication awards. METABOLOMICS, 19 (4). 27-.

Shams, Sahand, Lima, Cassio ORCID: 0000-0002-9062-6298, Xu, Yun ORCID: 0000-0003-3228-5111, Ahmed, Shwan, Goodacre, Royston ORCID: 0000-0003-2230-645X and Muhamadali, Howbeer (2023) Optical photothermal infrared spectroscopy: A novel solution for rapid identification of antimicrobial resistance at the single-cell level <i>via</i> deuterium isotope labeling. FRONTIERS IN MICROBIOLOGY, 14. 1077106-.

Alboniga, Oihane E, Gonzalez, Oskar, Alonso, Rosa M, Xu, Yun ORCID: 0000-0003-3228-5111 and Goodacre, Royston ORCID: 0000-0003-2230-645X (2020) Optimization of XCMS parameters for LC-MS metabolomics: an assessment of automated versus manual tuning and its effect on the final results. METABOLOMICS, 16 (1). 14-.

Ventura, Giovanni, Calvano, Cosima D, Porcelli, Vito, Palmieri, Luigi, De Giacomo, Andrea, Xu, Yun ORCID: 0000-0003-3228-5111, Goodacre, Royston ORCID: 0000-0003-2230-645X, Palmisano, Francesco and Cataldi, Tommaso RI (2020) Phospholipidomics of peripheral blood mononuclear cells (PBMCs): the tricky case of children with autism spectrum disorder (ASD) and their healthy siblings. ANALYTICAL AND BIOANALYTICAL CHEMISTRY, 412 (25). pp. 6859-6874.

Aharoni, Asaph, Goodacre, Royston ORCID: 0000-0003-2230-645X and Fernie, Alisdair R (2023) Plant and microbial sciences as key drivers in the development of metabolomics research. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 120 (12). e2217383120-.

Rani, Ekta, Mohshim, Siti Akhtar, Ahmad, Muhammad Zamharir, Goodacre, Royston ORCID: 0000-0003-2230-645X, Ahmad, Shahrul Ainliah Alang and Wong, Lu Shin (2019) Polymer Pen Lithography-Fabricated DNA Arrays for Highly Sensitive and Selective Detection of Unamplified Ganoderma Boninense DNA. POLYMERS, 11 (3). E561-.

Varnasseri, Mehrvash, Muhamadali, Howbeer, Xu, Yun ORCID: 0000-0003-3228-5111, Richardson, Paul IC, Byrd, Nick, Ellis, David I, Matousek, Pavel and Goodacre, Royston ORCID: 0000-0003-2230-645X (2021) Portable through Bottle SORS for the Authentication of Extra Virgin Olive Oil. APPLIED SCIENCES-BASEL, 11 (18). p. 8347.

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Langer, Judith, Jimenez de Aberasturi, Dorleta, Aizpurua, Javier, Alvarez-Puebla, Ramon A, Auguié, Baptiste, Baumberg, Jeremy J, Bazan, Guillermo C, Bell, Steven EJ, Boisen, Anja, Brolo, Alexandre G et al (show 49 more authors) , Choo, Jaebum, Cialla-May, Dana, Deckert, Volker, Fabris, Laura, Faulds, Karen, García de Abajo, F Javier, Goodacre, Royston ORCID: 0000-0003-2230-645X, Graham, Duncan, Haes, Amanda J, Haynes, Christy L, Huck, Christian, Itoh, Tamitake, Käll, Mikael, Kneipp, Janina, Kotov, Nicholas A, Kuang, Hua, Le Ru, Eric C, Lee, Hiang Kwee, Li, Jian-Feng, Ling, Xing Yi, Maier, Stefan A, Mayerhöfer, Thomas, Moskovits, Martin, Murakoshi, Kei, Nam, Jwa-Min, Nie, Shuming, Ozaki, Yukihiro, Pastoriza-Santos, Isabel, Perez-Juste, Jorge, Popp, Juergen, Pucci, Annemarie, Reich, Stephanie, Ren, Bin, Schatz, George C, Shegai, Timur, Schlücker, Sebastian, Tay, Li-Lin, Thomas, K George, Tian, Zhong-Qun, Van Duyne, Richard P, Vo-Dinh, Tuan, Wang, Yue, Willets, Katherine A, Xu, Chuanlai, Xu, Hongxing, Xu, Yikai, Yamamoto, Yuko S, Zhao, Bing and Liz-Marzán, Luis M (2019) Present and Future of Surface-Enhanced Raman Scattering. ACS nano, 14 (1). pp. 28-117.

Kirwan, Jennifer A, Gika, Helen, Beger, Richard D, Bearden, Dan, Dunn, Warwick B, Goodacre, Royston ORCID: 0000-0003-2230-645X, Theodoridis, Georgios, Witting, Michael, Yu, Li-Rong and Wilson, Ian D ORCID: 0000-0002-8558-7394 (2022) Quality assurance and quality control reporting in untargeted metabolic phenotyping: mQACC recommendations for analytical quality management. METABOLOMICS, 18 (9). 70-.

McAvan, Bethan S, France, Aidan P, Bellina, Bruno, Barran, Perdita E, Goodacre, Royston ORCID: 0000-0003-2230-645X and Doig, Andrew J (2020) Quantification of protein glycation using vibrational spectroscopy. The Analyst, 145 (10). pp. 3686-3696.

Richardson, Paul IC, Burke, Adam ORCID: 0000-0002-3201-2116, Gotts, Nigel and Goodacre, Royston ORCID: 0000-0003-2230-645X (2023) Quantifying PG : VG ratio and nicotine content in commercially available e-liquids using handheld Raman spectroscopy. ANALYST, 148 (17). pp. 4002-4011.

Roberts, Ivayla, Muelas, Marina Wright, Taylor, Joseph, Davison, Andrew ORCID: 0000-0001-5501-4475, Winder, Catherine, Goodacre, Royston ORCID: 0000-0003-2230-645X and Kell, Douglas ORCID: 0000-0001-5838-7963 (2023) Quantitative LC-MS study of compounds found predictive of COVID-19 severity and outcome. [Preprint]

Roberts, Ivayla, Wright Muelas, Marina, Taylor, Joseph M, Davison, Andrew S, Winder, Catherine L, Goodacre, Royston ORCID: 0000-0003-2230-645X and Kell, Douglas B ORCID: 0000-0001-5838-7963 (2023) Quantitative LC-MS study of compounds found predictive of COVID-19 severity and outcome. Metabolomics : Official journal of the Metabolomic Society, 19 (11). 87-.

Chisanga, Malama ORCID: 0000-0002-1481-1299, Muhamadali, Howbeer, Kimber, Richard and Goodacre, Royston ORCID: 0000-0003-2230-645X (2017) Quantitative detection of isotopically enriched <i>E</i>. <i>coli</i> cells by SERS. FARADAY DISCUSSIONS, 205. pp. 331-343.

Foster, Lynn, Muhamadali, Howbeer, Boothman, Christopher, Sigee, David, Pittman, Jon K, Goodacre, Royston ORCID: 0000-0003-2230-645X, Morris, Katherine and Lloyd, Jonathan R (2020) Radiation Tolerance of <i>Pseudanabaena catenata</i>, a Cyanobacterium Relevant to the First Generation Magnox Storage Pond. FRONTIERS IN MICROBIOLOGY, 11. 515-.

McAvan, Bethan S, Bowsher, Leo A, Powell, Thomas, O'Hara, John F, Spitali, Mariangela, Goodacre, Royston ORCID: 0000-0003-2230-645X and Doig, Andrew J (2020) Raman Spectroscopy to Monitor Post-Translational Modifications and Degradation in Monoclonal Antibody Therapeutics. Analytical Chemistry, 92 (15). pp. 10381-10389.

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Dodd, Liam J, Lima, Cassio ORCID: 0000-0002-9062-6298, Costa-Milan, David, Neale, Alex R ORCID: 0000-0001-7675-5432, Saunders, Benedict, Zhang, Bowen, Sarua, Andrei, Goodacre, Royston ORCID: 0000-0003-2230-645X, Hardwick, Laurence J ORCID: 0000-0001-8796-685X, Kuball, Martin et al (show 1 more authors) and Hasell, Tom (2023) Raman analysis of inverse vulcanised polymers. POLYMER CHEMISTRY, 14 (12). pp. 1369-1386.

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Theakstone, Ashton G, Brennan, Paul M, Jenkinson, Michael D ORCID: 0000-0003-4587-2139, Mills, Samantha J, Syed, Khaja, Rinaldi, Christopher, Xu, Yun ORCID: 0000-0003-3228-5111, Goodacre, Royston ORCID: 0000-0003-2230-645X, Butler, Holly J, Palmer, David S et al (show 2 more authors) , Smith, Benjamin R and Baker, Matthew J (2021) Rapid Spectroscopic Liquid Biopsy for the Universal Detection of Brain Tumours. Cancers, 13 (15). p. 3851.

Allwood, J William, Xu, Yun ORCID: 0000-0003-3228-5111, Martinez-Martin, Pilar, Palau, Raphaelle, Cowan, Alexander, Goodacre, Royston ORCID: 0000-0003-2230-645X, Marshall, Athole, Stewart, Derek and Howarth, Catherine (2019) Rapid UHPLC-MS metabolite profiling and phenotypic assays reveal genotypic impacts of nitrogen supplementation in oats. METABOLOMICS, 15 (3). 42-.

AlMasoud, Najla, Alomar, Taghrid S, Xu, Yun ORCID: 0000-0003-3228-5111, Lima, Cassio ORCID: 0000-0002-9062-6298 and Goodacre, Royston ORCID: 0000-0003-2230-645X (2023) Rapid detection and quantification of paracetamol and its major metabolites using surface enhanced Raman scattering. ANALYST, 148 (8). pp. 1805-1814.

Varnasseri, Mehrvash, Xu, Yun ORCID: 0000-0003-3228-5111 and Goodacre, Royston ORCID: 0000-0003-2230-645X (2022) Rapid detection and quantification of the adulteration of orange juice with grapefruit juice using handheld Raman spectroscopy and multivariate analysis. ANALYTICAL METHODS, 14 (17). D1663-D1670.

Chisanga, Malama ORCID: 0000-0002-1481-1299, Linton, Dennis, Muhamadali, Howbeer, Ellis, David I, Kimber, Richard L, Mironov, Aleksandr and Goodacre, Royston ORCID: 0000-0003-2230-645X (2019) Rapid differentiation of Campylobacter jejuni cell wall mutants using Raman spectroscopy, SERS and mass spectrometry combined with chemometrics. The Analyst, 145 (4). pp. 1236-1249.

Richardson, Paul IC, Muhamadali, Howbeer, Ellis, David I and Goodacre, Royston ORCID: 0000-0003-2230-645X (2019) Rapid quantification of the adulteration of fresh coconut water by dilution and sugars using Raman spectroscopy and chemometrics. FOOD CHEMISTRY, 272. pp. 157-164.

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Sala, Alexandra, Theakstone, Ashton G, Brennan, Paul M, Jenkinson, Michael D, Mills, Samantha J, Syed, Khaja, Rinaldi, Christopher, Xu, Yun ORCID: 0000-0003-3228-5111, Goodacre, Royston ORCID: 0000-0003-2230-645X, Butler, Holly J et al (show 3 more authors) , Palmer, David S, Smith, Benjamin R and Baker, Matthew J (2022) Rapid spectroscopic liquid biopsy for the early detection of brain tumors. .

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Sala, Alexandra, Theakstone, Ashton G, Brennan, Paul M, Jenkinson, Michael D, Mills, Samantha J, Syed, Khaja, Rinaldi, Christopher, Xu, Yun ORCID: 0000-0003-3228-5111, Goodacre, Royston ORCID: 0000-0003-2230-645X, Butler, Holly J et al (show 3 more authors) , Palmer, David S, Smith, Benjamin R and Baker, Matthew J (2022) Rapid spectroscopic liquid biopsy for the early detection of brain tumors. .

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Lippa, Katrice A, Aristizabal-Henao, Juan J, Beger, Richard D, Bowden, John A, Broeckling, Corey, Beecher, Chris, Clay Davis, W, Dunn, Warwick B ORCID: 0000-0001-6924-0027, Flores, Roberto, Goodacre, Royston ORCID: 0000-0003-2230-645X et al (show 16 more authors) , Gouveia, Gonçalo J, Harms, Amy C, Hartung, Thomas, Jones, Christina M, Lewis, Matthew R, Ntai, Ioanna, Percy, Andrew J, Raftery, Dan, Schock, Tracey B, Sun, Jinchun, Theodoridis, Georgios, Tayyari, Fariba, Torta, Federico, Ulmer, Candice Z, Wilson, Ian ORCID: 0000-0002-8558-7394 and Ubhi, Baljit K (2022) Reference materials for MS-based untargeted metabolomics and lipidomics: a review by the metabolomics quality assurance and quality control consortium (mQACC). Metabolomics : Official journal of the Metabolomic Society, 18 (4). p. 24.

Lima, Cassio, Muhamadali, Howbeer and Goodacre, Royston ORCID: 0000-0003-2230-645X (2021) The Role of Raman Spectroscopy Within Quantitative Metabolomics. Annual Review of Analytical Chemistry, 14 (1). pp. 323-345.

Williams, Alex, Langridge, Holly, Straathof, Angela L, Muhamadali, Howbeer, Hollywood, Katherine A, Goodacre, Royston ORCID: 0000-0003-2230-645X and de Vries, Franciska T (2022) Root functional traits explain root exudation rate and composition across a range of grassland species. JOURNAL OF ECOLOGY, 110 (1). pp. 21-33.

Rani, Ekta, Mohshim, Siti Akhtar, Yusof, Nor Hidayat, Ahmad, Muhammad Zamharir, Goodacre, Royston ORCID: 0000-0003-2230-645X, Alang Ahmad, Shahrul Ainliah and Wong, Lu Shin (2020) Sensitive and selective detection of DNA fragments associated with Ganoderma boninense by DNA-nanoparticle conjugate hybridisation. Journal of Materials Science, 55 (30). pp. 14965-14979.

Alomar, Taghrid S, AlMasoud, Najla, Xu, Yun ORCID: 0000-0003-3228-5111, Lima, Cassio, Akbali, Baris ORCID: 0000-0002-6852-2193, Maher, Simon and Goodacre, Royston ORCID: 0000-0003-2230-645X (2022) Simultaneous Multiplexed Quantification of Banned Sudan Dyes Using Surface Enhanced Raman Scattering and Chemometrics. Sensors, 22 (20). p. 7832.

Lima, Cassio ORCID: 0000-0002-9062-6298, Muhamadali, Howbeer and Goodacre, Royston ORCID: 0000-0003-2230-645X (2022) Simultaneous Raman and Infrared Spectroscopy of Stable Isotope Labelled <i>Escherichia coli</i>. SENSORS, 22 (10). 3928-.

Lima, Cassio, Ahmed, Shwan, Xu, Yun ORCID: 0000-0003-3228-5111, Muhamadali, Howbeer, Parry, Christopher, McGalliard, Rachel J ORCID: 0000-0003-0320-9945, Carrol, Enitan D ORCID: 0000-0001-8357-7726 and Goodacre, Royston ORCID: 0000-0003-2230-645X (2022) Simultaneous Raman and infrared spectroscopy: a novel combination for studying bacterial infections at the single cell level. CHEMICAL SCIENCE, 13 (27). pp. 8171-8179.

Lima, Cassio, Theron, Chrispian W ORCID: 0000-0002-8522-6417, Muhamadali, Howbeer, Kell, Douglas B and Goodacre, Royston ORCID: 0000-0003-2230-645X (2021) Spectral artefacts induced by moving targets in live hyperspectral stimulated Raman spectroscopy: the case of lipid droplets in yeast cells. Clinical Spectroscopy, 3. p. 100014.

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Fornasaro, Stefano, Alsamad, Fatima, Baia, Monica, Batista de Carvalho, Luis AE, Beleites, Claudia, Byrne, Hugh J, Chiado, Alessandro, Chis, Mihaela, Chisanga, Malama ORCID: 0000-0002-1481-1299, Daniel, Amuthachelvi et al (show 34 more authors) , Dybas, Jakub, Eppe, Gauthier, Falgayrac, Guillaume, Faulds, Karen, Gebavi, Hrvoje, Giorgis, Fabrizio, Goodacre, Royston ORCID: 0000-0003-2230-645X, Graham, Duncan, La Manna, Pietro, Laing, Stacey, Litti, Lucio, Lyng, Fiona M, Malek, Kamilla, Malherbe, Cedric, Marques, Maria PM, Meneghetti, Moreno, Mitri, Elisa, Mohacek-Grosev, Vlasta, Morasso, Carlo, Muhamadali, Howbeer, Musto, Pellegrino, Novara, Chiara, Pannico, Marianna, Penel, Guillaume, Piot, Olivier, Rindzevicius, Tomas, Rusu, Elena A, Schmidt, Michael S, Sergo, Valter, Sockalingum, Ganesh D, Untereiner, Valerie, Vanna, Renzo, Wiercigroch, Ewelina and Bonifacio, Alois (2020) Surface Enhanced Raman Spectroscopy for Quantitative Analysis: Results of a Large-Scale European Multi-Instrument Interlaboratory Study. ANALYTICAL CHEMISTRY, 92 (5). pp. 4053-4064.

Chisanga, Malama ORCID: 0000-0002-1481-1299, Muhamadali, Howbeer, Ellis, David I and Goodacre, Royston ORCID: 0000-0003-2230-645X (2018) Surface-Enhanced Raman Scattering (SERS) in Microbiology: Illumination and Enhancement of the Microbial World. APPLIED SPECTROSCOPY, 72 (7). pp. 987-1000.

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Scott, Jennifer, Sueiro-Olivares, Monica, Thornton, Benjamin P, Owens, Rebecca A, Muhamadali, Howbeer, Fortune-Grant, Rachael, Thomson, Darren, Thomas, Riba, Hollywood, Katherine, Doyle, Sean et al (show 4 more authors) , Goodacre, Royston ORCID: 0000-0003-2230-645X, Tabernero, Lydia, Bignell, Elaine and Amich, Jorge (2020) Targeting Methionine Synthase in a Fungal Pathogen Causes a Metabolic Imbalance That Impacts Cell Energetics, Growth, and Virulence. MBIO, 11 (5). e01985-e01920.

Ellis, David I, Eccles, Rebecca, Xu, Yun ORCID: 0000-0003-3228-5111, Griffen, Julia, Muhamadali, Howbeer, Matousek, Pavel, Goodall, Ian and Goodacre, Royston ORCID: 0000-0003-2230-645X (2017) Through-container, extremely low concentration detection of multiple chemical markers of counterfeit alcohol using a handheld SORS device. SCIENTIFIC REPORTS, 7 (1). 12082-.

Weerathunge, Pabudi, Ramanathan, Rajesh, Torok, Valeria A, Hodgson, Kate, Xu, Yun ORCID: 0000-0003-3228-5111, Goodacre, Royston ORCID: 0000-0003-2230-645X, Behera, Bijay Kumar and Bansal, Vipul (2019) Ultrasensitive Colorimetric Detection of Murine Norovirus Using NanoZyme Aptasensor. ANALYTICAL CHEMISTRY, 91 (5). pp. 3270-3276.

Muhamadali, Howbeer, Winder, Catherine L, Dunn, Warwick B and Goodacre, Royston ORCID: 0000-0003-2230-645X (2023) Unlocking the secrets of the microbiome: exploring the dynamic microbial interplay with humans through metabolomics and their manipulation for synthetic biology applications. The Biochemical journal, 480 (12). pp. 891-908.

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van Oort, Pouline MP, Nijsen, Tamara M, White, Iain R, Knobel, Hugo H, Felton, Timothy, Rattray, Nicholas, Lawal, Oluwasola, Bulut, Murtaza, Ahmed, Waqar, Artigas, Antonio et al (show 8 more authors) , Povoa, Pedro R, Martin-Loeches, Ignacio, Weda, Hans, Goodacre, Royston ORCID: 0000-0003-2230-645X, Schultz, Marcus J, Dark, Paul M, Fowler, Stephen J and Bos, Lieuwe D (2022) Untargeted Molecular Analysis of Exhaled Breath as a Diagnostic Test for Ventilator-Associated Lower Respiratory Tract Infections (BreathDx). THORAX, 77 (1). pp. 79-81.

Roberts, Ivayla, Muelas, Marina Wright, Taylor, Joseph M, Davison, Andrew S ORCID: 0000-0001-5501-4475, Xu, Yun ORCID: 0000-0003-3228-5111, Grixti, Justine M, Gotts, Nigel, Sorokin, Anatolii, Goodacre, Royston ORCID: 0000-0003-2230-645X and Kell, Douglas B ORCID: 0000-0001-5838-7963 (2022) Untargeted metabolomics of COVID-19 patient serum reveals potential prognostic markers of both severity and outcome. METABOLOMICS, 18 (1). 6-.

Roberts, Ivayla ORCID: 0000-0003-3525-9787, Muelas, Marina Wright, Taylor, Joseph, Davison, Andrew ORCID: 0000-0001-5501-4475, Xu, Yun, Grixti, Justine, Gotts, Nigel, Sorokin, Anatolii, Goodacre, Royston and Kell, Douglas ORCID: 0000-0001-5838-7963 (2020) Untargeted metabolomics of COVID-19 patient serum reveals potential prognostic markers of both severity and outcome.

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Carbonell, Pablo, Jervis, Adrian J, Robinson, Christopher J, Yan, Cunyu, Dunstan, Mark, Swainston, Neil ORCID: 0000-0001-7020-1236, Vinaixa, Maria, Hollywood, Katherine A, Currin, Andrew, Rattray, Nicholas JW et al (show 19 more authors) , Taylor, Sandra, Spiess, Reynard, Sung, Rehana, Williams, Alan R, Fellows, Donal, Stanford, Natalie J, Mulherin, Paul, Le Feuvre, Rosalind, Barran, Perdita, Goodacre, Royston ORCID: 0000-0003-2230-645X, Turner, Nicholas J, Goble, Carole, Chen, George Guoqiang, Kell, Douglas B ORCID: 0000-0001-5838-7963, Micklefield, Jason, Breitling, Rainer, Takano, Eriko, Faulon, Jean-Loup and Scrutton, Nigel S (2018) An automated Design-Build-Test-Learn pipeline for enhanced microbial production of fine chemicals. COMMUNICATIONS BIOLOGY, 1 (1). 66-.

Goodacre, Royston ORCID: 0000-0003-2230-645X (2019) <i>The blind men and the elephant</i>: challenges in the analysis of complex natural mixtures. FARADAY DISCUSSIONS, 218. pp. 524-539.

Ashrafi, Mohammed, Xu, Yun ORCID: 0000-0003-3228-5111, Muhamadali, Howbeer, White, Iain, Wilkinson, Maxim, Hollywood, Katherine, Baguneid, Mohamed, Goodacre, Royston ORCID: 0000-0003-2230-645X and Bayat, Ardeshir (2020) A microbiome and metabolomic signature of phases of cutaneous healing identified by profiling sequential acute wounds of human skin: An exploratory study. PLOS ONE, 15 (2). e0229545-.

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Sarmad, Sarir, Viant, Mark R, Dunn, Warwick B ORCID: 0000-0001-6924-0027, Goodacre, Royston ORCID: 0000-0003-2230-645X, Wilson, Ian D ORCID: 0000-0002-8558-7394, Chappell, Katie E, Griffin, Julian L, O'Donnell, Valerie B, Naicker, Brendon, Lewis, Matthew R et al (show 2 more authors) , Suzuki, Toru and UK Consortium on Metabolic Phenotyping (MAP/UK), (2023) A proposed framework to evaluate the quality and reliability of targeted metabolomics assays from the UK Consortium on Metabolic Phenotyping (MAP/UK). Nature protocols, 18 (4). pp. 1017-1027.