Projects per year
Personal profile
Biography
I read Physics at Oxford and after graduating worked for some years as a Patent Examiner at the European Patent Offices in the Netherlands and Germany. On returning to the UK, I joined the Institute of Food Research to work on infrared sensor design, and my PhD research focused on chemometric analysis of the large datasets produced by infrared and Raman spectrscopy.
Since then, my interests have included applications of computational statistics, machine- and deep-learning to a wide range of data types, from electrophoresis, chemical imaging, and electromyography to the metabolomics platform technologies (NMR and LC-MS). Key areas of application have been natural product integrity issues, such as detecting adulteration of edible oils, processed fruits, meat products, coffee and spices. I lead the UEA's Centre of Expertise in Food Authenticity, part of the UK's Food Authenticity Network, a virtual reference laboratory for the measurement of food integrity.
Much of my research is aligned to industrial application, and I collaborate closely with a range of partners in the forensic, food, pharma and instrumentation sectors. In recent years I have concentrated on the analysis of data produced by high-resolution NMR, including by the emerging low-field 'benchtop' technology.
Concurrent with my position of Professor of A.I. in Chemistry at UEA, I am a Scientific Director at Mestrelab Research S.L, a scientific software house and division of the Bruker Corporation. My research interests here are in small molecule cheminformatics: using convolutional neural networks and graph theory to explore associations between structure and physical properties, and in applications of machine learning to automation and high-throughput analysis.
Education/Academic qualification
Doctor of Philosophy
Award Date: 1 Dec 1998
Master of Physics, University of Oxford
External positions
Member, DEFRA Expert Committee, Authenticity Methodology Working Group (AMWG)
1 Apr 2024 → 30 Mar 2027
Scientific Director, Mestrelab Research S.L.
2 Oct 2023 → …
Collaborations and top research areas from the last five years
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Identifying the Dietary Signatures of Arthritis through metabolomics (the DeSignA study)
Macgregor, A., Clark, I., Davidson, R., Kemsley, K., Le Gall, G., Yates, M. & Chipping, J.
1/05/23 → 30/04/25
Project: Research
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A.I. and Graph Theoretical Approaches to Small Molecule Structure Elucidation
1/10/24 → 30/09/27
Project: Training
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Chemical shift prediction in 13C NMR spectroscopy using ensembles of message passing neural networks (MPNNs)
Williamson, D., Ponte, S., Iglesias, I., Cobas, C., Tonge, N. M. & Kemsley, E. K., 12 Sep 2024, SSRN.Research output: Working paper › Preprint
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Chemical Shift Prediction using Message Passing Neural Networks
Cobas, C., Iglesias, I., Kemsley, E. K., Lachenmann, M., Ponte, S., Tonge, N. & Williamson, D., 15 Sep 2024.Research output: Contribution to conference › Poster › peer-review
Open AccessFile6 Downloads (Pure) -
CoE profile: University of East Anglia Centre of Expertise in Food Authenticity
Kemsley, E. K., 31 May 2024, Food Authenticity Netowrk (FAN) Newsletter, p. 12 1 p.Research output: Contribution to specialist publication › Article
Open AccessFile8 Downloads (Pure) -
Graphical exploration of 600-and 60-MHz proton NMR spectral datasets from ground roast coffee extracts
Kemsley, E. K., Apr 2024, In: Magnetic Resonance in Chemistry. 62, 4, p. 236-251 16 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile1 Citation (Scopus)4 Downloads (Pure) -
Identifying the dietary signatures of arthritis through metabolomics
Cobas, C., Defernez, M., Kemsley, E. K., Lachenmann, M., Le Gall, G., MacGregor, A., Pirt, J., Varshavi, D. & Wachowiak, E., 15 Sep 2024.Research output: Contribution to conference › Poster › peer-review
Open AccessFile3 Downloads (Pure)
Activities
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Advances in Food and Beverage Testing 2024
Kate Kemsley (Invited speaker)
24 Jul 2024Activity: Participating in or organising an event › Participation in conference
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Podcast: AI Modelling of Molecular Properties
Kate Kemsley (Contributor)
13 May 2024Activity: Other activity types › Other
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DEFRA Expert Committee, Authenticity Methodology Working Group (AMWG) (External organisation)
Kate Kemsley (Member)
1 Apr 2024 → …Activity: Membership › Public/government panel or group
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35th Meeting of the Defra AMWG (Authenticity Methodology Working Group)
Kate Kemsley (Member of programme committee)
22 Feb 2024Activity: Participating in or organising an event › Participation in workshop or seminar