Phone:: (023) 8059 3209
Email:: J.G.Frey@soton.ac.uk

Professor Jeremy G Frey BA, MA, DPhil, FRSC, FRSS, M Inst. P,

Professor of Physical Chemistry, Head of Computational Systems Chemistry,PI and Champion of the IT as a Utility RCUK Digital Economy Challenge Area

Related links: Personal homepage

Professor Jeremy G Frey is Professor of Physical Chemistry within the academic unit of Chemistry at the University of Southampton.

An integrated and multi-disciplinary approach to research

ResearcherID

ORCID

Jeremy Frey obtained his DPhil on experimental and theoretical aspects of van der Waals complexes in the Physical Chemistry Labs, Oxford University under the supervision of Professor Brian Howard, followed by a NATO/EPSRC fellowship at the Lawrence Berkeley Laboratory and University of California, with Professor Y. T. Lee. In 1984 he took up a lectureship at the University of Southampton, where he is now Professor of Physical Chemistry. His experimental research probes molecular organization in environments from single molecules in molecular beams to liquid interfaces using laser spectroscopy from the IR to soft X-rays. He investigates how e-Science infrastructure supports scientific research with an emphasis on the way digital infrastructure can enhance the intelligent creation, dissemination and analysis of scientific data.

Twitter @profechem

Google scholar profile

LinkedIn Profile

Researchgate

Theory and Modelling in Chemical Sciences CDT PI of the Digital Economy IT as a Utility Network+

Research

Responsibilities

Publications

Teaching

Contact

Research interests

The applications of linear and non-linear spectroscopy and imaging to the study of interfacial and nano-scale chemistry. Looking at the molecular organisation and chemistry of the air/water and oil/water interfaces, with applications to environmental (atmospheric) chemistry, biological and industrial processes.

The application of modern computer (web) science to the chemistry research process for experimental laboratory research and computational studies – “from the Laboratory to literature and back” as an illustration of the wider impact of the World Wide Web and Digital Economy on science and the citizen.

I am an associate member of the Southampton Statistical Sciences Research Institute – S3RI, https://www.southampton.ac.uk/s3ri

and a member of the Institute for Life Sciences (IfLS) https://www.southampton.ac.uk/ifls

Co-Chair of the Computationally Intensive Imaging USRG: https://www.southampton.ac.uk/imaging/

Member of the Antimicrobial resistance network (NAMRA) with research on the use of Cognitive Computing – link is https://www.southampton.ac.uk/namrip/research/jeremy-frey-cc.page

PhD Supervision

Current students

Nicola Knight

Ed Jager

Matt Parsons

Frank Longford

Lee Steinberg

Jeny Fan

Samantha Kanza (Web science)

also see students with the joint Laser X-Ray Project joint with Bill Brocklesby, ORC

Post-Docs / Research Assistants

Steve Brewer

Naruo Yoshihora

Visitors

Colin Bird

Richard Chapman

Fiona Bell

Cerys Willoughby

Company Links

Microsoft, IBM, Lonza, Syngenta

MPhil/PhD research

x-ray microscopy

High Harmonic Generation

Chemical Informatics & Semantic Web

Non-linear spectroscopy and imaging

Structure and chemistry of the air/water and oil/water interfaces

Digital Economy and IT as a Utility

Research group

Computational Systems Chemistry

Research project(s)

Frey: Laser spectroscopy

Frey: End-to-End Digital Support for Chemical Research e-Science Project

Frey: Ultrafast nanscale x–ray scattering

Frey: IT as a Utility

Optimal design of experiments for second harmonic generation in chemistry

Internal

Head of Computational Chemical Systems Group

External

RSC
Member of RSC Faraday Council
Vice Chair and Secretary of the Chemical Information and Computer Application Group(CICAG) committee
Member of the RSC Nomenclature Committee
Member of the RSC IUPAC Committee

IUPAC
Member of the Committee on Electronic Publications and Chemical Data Standards (CEPCDS)
Member of the Commission 1.1 The Green Book

Key Publications

Anderson, P. N., Horak, P., Frey, J. G., & Brocklesby, W. S. (2014). High-energy laser-pulse self-compression in short gas-filled fibers. Physical Review A, 89(1), 13819. DOI: 10.1103/PhysRevA.89.013819

Smalheiser, N. R., Milsted, A. J., Hale, J. R., Frey, J. G., & Neylon, C. (2013). LabTrove: a lightweight, web based, laboratory “blog” as a route towards a marked up record of work in a bioscience research laboratory. PLoS ONE, 8(7), e67460-[18pp]. DOI: 10.1371/journal.pone.0067460

Bird, C., & Frey, J. G. (2013). Chemical information matters: an e-Research perspective on information and data sharing in the chemical sciences. Chemical Society Reviews, 42(16), 6754-6775. DOI: 10.1039/C3CS60050E

Gale, P. A., Busschaert, N., Bradberry, S. J., Wenzel, M., Haynes, C., Hiscock, J. R., ... Frey, J. G. (2013). Towards predictable transmembrane transport: QSAR analysis of anion binding and anion transport. Chemical Science, 4(8), 3036-3045. DOI: 10.1039/C3SC51023A

Butcher, T. J., Anderson, P. N., Chapman, R. T., Horak, P., Frey, J. G., & Brocklesby, W. S. (2013). Bright extreme-ultraviolet high-order-harmonic radiation from optimized pulse compression in short hollow waveguides. Physical Review A, 87(4), 1-4. DOI: 10.1103/PhysRevA.87.043822

Niga, P., Johnson, C. M., Frey, J. G., & Rutland, M. W. (2011). Crown ethers at the aqueous solution–air interface. Part 2. Electrolyte effects, ethylene oxide hydration and temperature behaviour. Physical Chemistry Chemical Physics. DOI: 10.1039/C0CP02144J

Articles

Bruno, I., & Frey, J. G. (2017). Connecting chemistry with global challenges through data standards. Chemistry International, 39(3). DOI: 10.1515/ci-2017-0303

Kanza, S., Willoughby, C., Gibbins, N., Whitby, R. J., Frey, J., Erjavec, J., ... Kovač, K. (2017). Electronic Lab Notebooks: can they replace paper? Journal of Cheminformatics.

Willoughby, C., Logothetis, T., & Frey, J. (2016). Effects of using structured templates for recalling chemistry experiments. Journal of Cheminformatics, 8(9), 1-17. DOI: 10.1186/s13321-016-0118-6

Feehan, J. S., Price, J. H. V., Butcher, T., Brocklesby, W. S., Frey, J. G., & Richardson, D. J. (2016). Efficient high-harmonic generation from a stable and compact ultrafast Yb-fiber laser producing 100 micro-joule, 350 fs pulses based on bendable photonic-crystal fiber. Applied Physics B, 1-14. DOI: 10.1007/s00340-016-6620-8

Kim, H., Baksh, P., Odstrčil, M., Miszczak, M., Juschkin, L., Brocklesby, W., & Frey, J. (2016). Lloyd's mirror interference lithography with EUV radiation from a high-harmonic source. Applied Physics Express, 9(7), 76701. DOI: 10.7567/APEX.9.076701

Odstrčil, M., Baksh, P., Gawith, C., Vrcelj, R., Frey, J., & Brocklesby, W. (2016). Nonlinear ptychographic coherent diffractive imaging. Optics Express, 1-9. DOI: 10.1364/OE.24.020245

Odstrčil, M., Baksh, P., Boden, S., Card, R., Chad, J., Frey, J., & Brocklesby, W. (2016). Ptychographic coherent diffractive imaging with orthogonal probe relaxation. Optics Express, 24(8), 8360-8369. DOI: 10.1364/OE.24.008360

Knight, N. J., Hernando, E., Haynes, C. J. E., Busschaert, N., Clarke, H. J., Takimoto, K., ... Gale, P. A. (2016). QSAR analysis of substituent effects on tambjamine anion transporters. Chemical Science, 1-9. DOI: 10.1039/C5SC03932K

Baksh, P., Odstrčil, M., Kim, H., Boden, S., Frey, J., & Brocklesby, W. (2016). Wide-field broadband EUV transmission ptychography using a high harmonic source. Optics Letters, 1-5. DOI: 10.1364/OL.41.001317

Day, A. E., Coles, S., Bird, C., Frey, J., Whitby, R., Tkachenko, V. E., & Williams, A. J. (2015). ChemTrove: Enabling a generic ELN to support chemistry through the use of transferable plug-ins and online data sources. Journal of Chemical Information and Modeling, 55(3), 501-509. DOI: 10.1021/ci5005948

Frey, J., Coles, S., Bird, C., & Willoughby, C. (2015). Collection, curation, citation at source: Publication@Source 10 years on. International Journal of Digital Curation, 10(2), 1-11. DOI: 10.2218/ijdc.v10i2.377

Badiola, K. A., Bird, C., Brocklesby, W., Casson, J., Chapman, R. T., Coles, S., ... Ylioja, P. M. (2015). Experiences with a researcher-centric ELN. Chemical Science, 6(3), 1614-1629. DOI: 10.1039/c4sc02128b

Bird, C., Coles, S. J., & Frey, J. G. (2015). The evolution of digital chemistry at Southampton. Molecular Informatics. DOI: 10.1002/minf.201500008

Willoughby, C., Bird, C., Coles, S. J., & Frey, J. G. (2014). Creating context for the experiment record. User-defined metadata: investigations into metadata usage in the LabTrove ELN. Journal of Chemical Information and Modeling, 1-16. DOI: 10.1021/ci500469f

Parker, R. M., Wales, D. J., Gates, J. C., Frey, J. G., Smith, P. G. R., & Grossel, M. C. (2014). Monolayer detection of ion binding at a crown ether-functionalised supramolecular surface via an integrated optical Bragg grating. The Analyst, 139, 2774-2782. DOI: 10.1039/C4AN00283K

Frey, J. G., & Bird, C. L. (2014). Scientific and technical data sharing: a trading perspective. Journal of Computer-Aided Molecular Design, 28(10), 989-996. DOI: 10.1007/s10822-014-9785-4

Borkum, M. I., & Frey, J. G. (2014). Usage and applications of Semantic Web techniques and technologies to support chemistry research. Journal of Cheminformatics, 6(1), 18. DOI: 10.1186/1758-2946-6-18

Frey, J. G., & Bird, C. (2013). Cheminformatics and the Semantic Web: adding value with linked data and enhanced provenance. Wiley Interdisciplinary Reviews: Computational Molecular Science, 3(5), 465-481. DOI: 10.1002/wcms.1127

Frey, J. G., Coles, S., Willoughby, C., & Bird, C. (2013). Data curation issues in the chemical sciences. Information Standards Quarterly, 25(3), 4-12. DOI: 10.3789/isqv25no3.2013.02

Coles, S. J., Frey, J. G., Bird, C. L., Whitby, R. J., & Day, A. E. (2013). First steps towards semantic descriptions of electronic laboratory notebook records. Journal of Cheminformatics, 5(52), 1-10. DOI: 10.1186/1758-2946-5-52

Bird, C. L., Willoughby, C., & Frey, J. G. (2013). Laboratory notebooks in the digital era: the role of ELNs in record keeping for chemistry and other sciences. Chemical Society Reviews, 42(20), 8157-8175. DOI: 10.1039/C3CS60122F

Frey, J. G., Milsted, A., Michaelides, D., & Roure, D. D. (2013). MyExperimentalScience, extending the ‘workflow’. Concurrency and Computation: Practice and Experience, 25(4), 481-496. DOI: 10.1002/cpe.2922

Coles, S. J., Whitby, R. J., Day, A., Willoughby, C., Tkachenko, V., Frey, J. G., & Williams, A. J. (2013). Tablets in the lab: enabling the flow of chemical synthesis data into a chemistry repository. Abstracts of Papers of the American Chemical Society.

Takeda, K., Earl, G., Frey, J., Keay, S., & Wade, A. (2012). Enhancing research publications using Rich Interactive Narratives. Philosophical Transactions of The Royal Society A: Mathematical Physical and Engineering Sciences, 371(1983), 1-10. DOI: 10.1098/rsta.2012.0090

Rogers, E. T. F., Stebbings, S. L., de Paula, A. M., Froud, C. A., Praeger, M., Mills, B., ... Frey, J. G. (2012). Spatiotemporal phase-matching in capillary high-harmonic generation. Journal of the Optical Society of America B, 29(4), 806-812. DOI: 10.1364/JOSAB.29.000806

Niga, P., King, W., Hedberg, J., Johnson, C. M., Frey, J. G., & Rutland, M. W. (2011). Crown ethers at the aqueous solution–air interface: 1. Assignments and surface spectroscopy. Physical Chemistry Chemical Physics, 2011(13), 7930-7938. DOI: 10.1039/C0CP00604A

Grant-Jacob, J., Mills, B., Butcher, T. J., Chapman, R. T., Brocklesby, W. S., & Frey, J. G. (2011). Gas jet structure influence on high harmonic generation. Optics Express, 19(10), 9801-9806. DOI: 10.1364/OE.19.009801

Frey, J. G., & Bird, C. L. (2011). Web-based services for drug design and discovery. Expert Opinion on Drug Discovery, 6(9), 885-895. DOI: 10.1517/17460441.2011.598924

Chapman, R. T., Butcher, T. J., Horak, P., Poletti, F., Frey, J. G., & Brocklesby, W. S. (2010). Modal effects on pump-pulse propagation in an Ar-filled capillary. Optics Express, 18(12), 13279-13284. DOI: 10.1364/OE.18.013279

Froud, C. A., Chapman, R. T., Rogers, E. T. F., Praeger, M., Mills, B., Grant-Jacob, J., ... Brocklesby, W. S. (2009). Spatially resolved Ar* and Ar+* imaging as a diagnostic for capillary-based high harmonic generation. Journal of Optics A: Pure and Applied Optics, 11(5), 054011-[7pp]. DOI: 10.1088/1464-4258/11/5/054011

Frey, J. G. (2009). The value of the semantic web in the laboratory. Drug Discovery Today, 14(11-12), 522-561. DOI: 10.1016/j.drudis.2009.03.007

Greef, R., Frey, J. G., Robinson, J., & Danos, L. (2008). Adsorption of rhodamine 6G at the water-air interface. Physica Status Solidi C: Current Topics in Solid State Physics, 5(5), 1187-1189. DOI: 10.1002/pssc.200777821

Frey, J. (2008). Curation of laboratory experimental data as part of the overall data lifecycle. International Journal of Digital Curation, 3(1).

Mills, B., Chau, C. F., Rogers, E. T. F., Grant-Jacob, J., Stebbings, S. L., Praeger, M., ... Frey, J. G. (2008). Direct measurement of the complex refractive index in the extreme ultraviolet spectral region using diffraction from a nanosphere array. Applied Physics Letters, 93(23), 231103-[3pp.]. DOI: 10.1063/1.3033549

Stebbings, S. L., Rogers, E. T. F., de Paula, A. M., Praeger, M., Froud, C. A., Mills, B., ... Frey, J. G. (2008). Molecular variation of capillary-produced soft x-ray high harmonics. Journal of Physics B: Atomic and Molecular Physics, 41(14), 145602. DOI: 10.1088/0953-4075/41/14/145602

Greef, R., & Frey, J. G. (2008). The water-like film on water. Physica Status Solidi C: Current Topics in Solid State Physics, 5(5), 1184-1186. DOI: 10.1002/pssc.200777820

Geldhill, R., Kent, S., Milsted, A., Chapman, R., Essex, J. W., & Frey, J. G. (2007). e-Malaria: the schools malaria project. Concurrency and Computation: Practice and Experience, 20(3), 225-238. DOI: 10.1002/cpe.1193

Tromp, M., Russu, S., Dent, A. J., Mosselmans, F. W., Harvey, I., Hayama, S., ... Evans, J. (2007). High-throughput structure/function screening of materials and catalysts with multiple spectroscopic techniques. AIP Conference Proceedings, 882, 858-860. DOI: 10.1063/1.2644684

Praeger, M., de Paula, A. M., Froud, C. A., Rogers, E. T. F., Stebbings, S. L., Brocklesby, W. S., ... Frey, J. G. (2007). Letter. Spatially resolved soft X-ray spectrometry from single-image diffraction. Nature Physics, 3(3), 176-179. DOI: 10.1038/nphys516

Gledhill, R., Kent, S., Hudson, B., Richards, W. G., Essex, J. W., & Frey, J. G. (2006). A computer-aided drug discovery system for chemistry teaching. Journal of Chemical Information and Modeling, 46(3), 960-970. DOI: 10.1021/ci050383q

Coles, S. J., Frey, J. G., Hursthouse, M. B., Light, M. E., Milsted, A. J., Carr, L. A., ... Day, M. (2006). An e-science environment for service crystallography: from submission to dissemination. Journal of Chemical Information and Modeling, 46(3), 1006-1016. DOI: 10.1021/ci050362w

Taylor, K. R., Gledhill, R., Essex, J. W., Frey, J. G., Harris, S. W., & De Roure, D. C. (2006). Bringing chemical data onto the semantic web. Journal of Chemical Information and Modeling, 46(3), 939-952. DOI: 10.1021/ci050378m

Birkin, P. R., Hirsimäki, H-M., Frey, J. G., & Leighton, T. G. (2006). Mass transfer enhancement produced by laser induced cavitation. Electrochemistry Communications, 8(10), 1603-1609. DOI: 10.1016/j.elecom.2006.07.026

Frey, J. G., King, R. C., & Moss, R. E. (2006). Multiphoton transitions for the harmonic oscillator. Molecular Physics, 104(15), 2523-2525. DOI: 10.1080/00268970600798038

Sono, T. J., Scott, J. G., Sones, C. L., Valdivia, C. E., Mailis, S., Eason, R. W., ... Danos, L. (2006). Reflection second harmonic generation on a z-cut congruent lithium niobate crystal. Physical Review B, 74(20), 205424-[7pp]. DOI: 10.1103/PhysRevB.74.205424

Froud, C. A., Rogers, E. T. F., Hanna, D. C., Brocklesby, W. S., Praeger, M., de Paula, A. M., ... Frey, J. G. (2006). Soft-x-ray wavelength shift induced by ionization effects in a capillary. Optics Letters, 31(3), 374-376. DOI: 10.1364/OL.31.000374

Taylor, K., Essex, J. W., Frey, J. G., Mills, H. R., Hughes, G., & Zaluska, E. J. (2006). The semantic grid and chemistry: experiences with CombeChem. Web Semantics, 4(2), 84-101. DOI: 10.1016/j.websem.2006.03.003

Woods, C. J., Ng, M. H., Johnston, S., Murdock, S. E., Wu, B., Tai, K., ... Essex, J. W. (2005). Grid computing and biomolecular simulation. Philosophical Transactions: Mathematical, Physical and Engineering Sciences, 363(1833), 2017-2035. DOI: 10.1098/rsta.2005.1626

Rousay, E. R., Fu, H., Robinson, J. M., Essex, J. W., & Frey, J. G. (2005). Grid-based dynamic electronic publication: a case study using combined experiment and simulation studies of crown ethers at the air/water interface. Philosophical Transactions: Mathematical, Physical and Engineering Sciences, 363(1833), 2075-2095. DOI: 10.1098/rsta.2005.1630

Mansson, R. A., Frey, J. G., Essex, J. W., & Welsh, A. H. (2005). Prediction of properties from simulations: a re-examination with modern statistical methods. Journal of Chemical Information and Modeling, 45(6), 1791-1803. DOI: 10.1021/ci050056i

Wong, L. S., Birembaut, F., Brocklesby, W. S., Frey, J. G., & Bradley, M. (2005). Resin bead micro-UV - visible absorption spectroscopy. Analytical Chemistry, 77(7), 2247-2251. DOI: 10.1021/ac049319i

Welsh, A. H., Mansson, R. A., Frey, J. G., & Danos, L. (2005). Statistical analysis of second harmonic generation experiments: a phenomenological model. Chemometrics and Intelligent Laboratory Systems, 75(1), 45-54. DOI: 10.1016/j.chemolab.2004.05.002

Essex, J. W., Woods, C. J., Willey, A. P., Fenu, L. A., Good, A. C., Leach, A. R., ... Frey, J. G. (2004). Application of distributed computing to computer simulations. Abstracts of Papers of the American Chemical Society, 227, p.U683.

Frey, J. G. (2004). Dark lab or smart lab: the challenges for 21st century laboratory software. Organic Process Research & Development, 8(6), 1024-1035. DOI: 10.1021/op049895g

Frey, J. G. (2004). Instruments on the grid: UK national crystallography grid service. Abstracts of Papers of the American Chemical Society, 227, U681-U681.

Frey, J. G., Hughes, G. V., Mills, H. R., Payne, T. R., schraefel, M. M., & Smith, G. M. (2004). Making tea: a human-centered approach to designing a pervasive lab book. Abstracts of Papers of the American Chemical Society, 227, U689.

Bullock, W. J., Fordyce, A. J., Spencer-Smith, R. D., & Frey, J. G. (2004). Probing possible structural models at the air/H2SO4(aq) interface: a second harmonic generation study. Physical Chemistry Chemical Physics, 9(2), 2415-2419. DOI: 10.1039/b313751a

Hughes, G., Mills, H., de Roure, D., Frey, J., Moreau, L., schraefel, M., ... Zaluska, E. (2004). The semantic smart laboratory: a system for supporting the chemical eScientist. Organic and Biomolecular Chemistry, 2(22), 3284-3293. DOI: 10.1039/b410075a

Coles, S. J., Frey, J. G., Gale, P. A., Hursthouse, M. B., Light, M. E., Navakhun, K., & Thomas, G. L. (2003). Anion-directed assembly: the first fluoride-directed double helix. Chemical Communications, 5, 568-569. DOI: 10.1039/b210847j

Timson, A. J., Spencer-Smith, R. D., Alexander, A. K., Greef, R., & Frey, J. G. (2003). Second harmonic ellipsometry. Measurement Science and Technology, 14(4), 508-515. DOI: 10.1088/0957-0233/14/4/315

Kress, J., Zanaletti, R., Rose, A., Frey, J. G., Brocklesby, W. S., Ladlow, M., & Bradley, M. (2003). Which sites react first? Functional site distribution and kinetics on solid supports investigated using confocal Raman and fluorescence microscopy. Journal of Combinatorial Chemistry, 5(1), 28-32. DOI: 10.1021/cc020024x

Kress, J., Zanaletti, R., Amour, A., Ladlow, M., Frey, J. G., & Bradley, M. (2002). Enzyme accessibility and solid supports: which molecular weight enzymes can be used on solid supports? An investigation using confocal Raman microscopy. Chemistry, 8(16), 3769-3772. DOI: 10.1002/1521-3765(20020816)8:16<3769::AID-CHEM3769>3.0.CO;2-V

Frey, J. G., Grossel, M. C., Timson, A. J., Golden, C., Macey, C., Ouick, D. W., & Rousay, E. R. (2002). Influence of cation binding on the structure of adsorbed layers of crown ethers and amino acid derivatives at the air water interface. Abstracts of Papers of the American Chemical Society, 224, U435-U436.

Jensen, K. B., Braxmeier, T. M., Demarcus, M., Frey, J. G., & Kilburn, J. D. (2002). Synthesis of guanidinium-derived receptor libraries and screening for selective peptide receptors in water. Chemistry, 8(6), 1300-1309. DOI: 10.1002/1521-3765(20020315)8:6<1300::AID-CHEM1300>3.0.CO;2-W

Botana, E., Ongeri, S., Arienzo, R., Demarcus, M., Frey, J. G., Piarulli, U., ... Kilburn, J. D. (2001). Enantioselective binding of dipeptides using acyclic receptors. Chemical Communications, (15), 1358-1359. DOI: 10.1039/b102383g

Kress, J., Rose, A., Frey, J. G., Brocklesby, W. S., Ladlow, M., Mellor, G. W., & Bradley, M. (2001). Site distribution in resin beads as determined by confocal Raman spectroscopy. Chemistry - A European Journal, 7(18), 3880-3883.

Botana, E., Ongeri, S., Arienzo, R., Demarcus, M., Frey, J. G., Piarulli, U., ... Gennari, C. (2001). Synthesis, conformational studies and binding properties of acyclic receptors for N-protected amino acids and dipeptides. European Journal of Organic Chemistry, (24), 4625-4634. DOI: 10.1002/1099-0690(200112)2001:24<4625::AID-EJOC4625>3.0.CO;2-L

Fordyce, A. J., Bullock, W. J., Timson, A. J., Haslam, S., Spencer-Smith, R. D. A., & Frey, J. G. (2001). The temperature dependence of surface second- harmonic generation from the air-water interface. Molecular Physics, 99(8), 677-687. DOI: 10.1080/00268970010030022

Frey, J. G. (2000). Interfacial second harmonic generation in the limit of weak orientational order: determining interfacial refractive index. Chemical Physics Letters, 323(5-6), 454-459. DOI: 10.1016/S0009-2614(00)00531-5

Bell, A. J., Boggis, S. A., Dyke, J. M., Frey, J. G., Richter, R., Shaw, N., & Tabrizchi, M. (1994). Ultraviolet photolysis of HOCl: REMPI measurement of the relative population of chlorine atom (P-2) spin-orbit states. Journal of the Chemical Society, Faraday Transactions, 90(1), 17-21. DOI: 10.1039/FT9949000017

Book

Frey, J. G., Robinson, J., Stanford-Clark, A., Reynolds, A., & Bendi, B. (2005). Sensor Networks and Grid Middleware for Laboratory Monitoring. USA: IEEE Computer Society.

Book Chapters

Frey, J., Bird, C., & Willoughby, C. (2013). Human aspects of smart spaces for knowledge transfer. In R. J. Howlett, B. Gabrys, K. Musial-Gabrys, & J. Roach (Eds.), Innovation through Knowledge Transfer 2012. (pp. 19-29). (Smart Innovation, Systems and Technologies; Vol. 18). London, GB: Springer. DOI: 10.1007/978-3-642-34219-6_3

Frey, J., Bird, C., & Willoughby, C. (2013). Smart meeting spaces for knowledge transfer. In R. J. Howlett, B. Gabrys, K. Musial-Gabrys, & J. Roach (Eds.), Innovation through Knowledge Transfer 2012. (pp. 31-38). (Smart Innovation, Systems and Technologies; Vol. 18). London, GB: Springer. DOI: 10.1007/978-3-642-34219-6_4

Frey, J., Bird, C., & Willoughby, C. (2013). Smart meetings: experimenting with space. In R. J. Howlett, B. Gabrys, K. Musial-Gabrys, & J. Roach (Eds.), Innovation through Knowledge Transfer 2012. (pp. 11-17). (Smart Innovation, Systems and Technologies; Vol. 18). London, GB: Springer. DOI: 10.1007/978-3-642-34219-6_2

Stebbings, S., Frey, J. G., & Brocklesby, W. S. (2010). An attosecond soft x-ray nanoprobe: new technology for molecular imaging. In M. Grishin (Ed.), Advances in Solid State Lasers Development and Applications. (pp. 489-508). Croatia: INTECH.

Frey, J. G., Bradley, M., Essex, J., Hursthouse, M. B., Lewis, S. M., Luck, M. M., ... Welsh, A. (2003). Combinatorial chemistry and the Grid. In F. Berman, A. J. G. Hey, & G. C. Fox (Eds.), Grid computing: making the global infrastructure a reality. (pp. 945-962). (Wiley Series in Communications Networking and Distributed Systems). Chichester, UK: John Wiley & Sons Ltd..

Conferences

Frey, J. (2017). Developing an open source ELN to support open & interdisciplinary science. Electronic Lab Notebooks: Solutions for Paperless Research, United Kingdom.

Odstrčil, M., Baksh, P., Kim, H., Brocklesby, W. S., & Frey, J. G. (2016). Coherent diffractive imaging with laboratory scale EUV sources. Paper presented at EXTATIC Welcome Week, United Kingdom.

Frey, J. G. (2016). Digital IUPAC: The need for global representation of chemistry and chemical information in the digital age. Paper presented at 251st American Chemical Society National Meeting & Exposition - Computers in Chemistry, United States.

Baksh, P., Odstrčil, M., Kim, H., Boden, S., Card, R., Chad, J., ... Frey, J. (2016). High resolution, wide field of view, ptychographic imaging of a biological sample using a high harmonic generation source. Paper presented at Conference on Lasers and Electro-Optics 2016, San Jose, United States.DOI: 10.1364/CLEO_SI.2016.SF1I.4

Frey, J. G. (2016). Is open science an inevitable outcome of e-science?. Paper presented at 251st American Chemical Society National Meeting & Exposition - Computers in Chemistry, United States.

Frey, J. G., Willoughby, C., Coles, S., Bird, C., & Whitby, R. (2016). Mobile interfaces for a digital research notebook. Paper presented at 251st Americal Chemical Society National Meeting & Exposition - Computers in Chemistry, United States.

Frey, J. G. (2015). IT for Health and Science. Disruptive technologies in health-care workshop, United Kingdom.

Odstrčil, M., Baksh, P. D., Boden, S. A., Brocklesby, W. S., & Frey, J. G. (2015). Laser driven table-top coherent EUV source for high resolution diffractive microscopy. Poster session presented at Symposium on Extreme Ultraviolet Lithography, Netherlands.

Odstrčil, M., Parson, M., Brocklesby, W. S., & Frey, J. G. (2015). Nonlinear coherent diffractive imaging (CDI). Paper presented at Lasers for Science Facility User Meeting, United Kingdom.

Frey, J. (2015). Publishing better science though better data. Publishing Better Science though Better Data, United Kingdom.

Baksh, P. D., Odstrčil, M., Parsons, A. D., Card, R., Boden, S., Brocklesby, W., & Frey, J. G. (2015). Towards laser driven table-top coherent diffractive X-ray microscopy of cultured hippocampal neurons. Poster session presented at BIO-NANO-Photonics 2015, United Kingdom.

Odstrčil, M., Baksh, P., Kim, H., Boden, S., Brocklesby, W., & Frey, J. (2015). Ultra-broadband ptychography with self-consistent coherence estimation from a high harmonic source. 958912-958912. Poster session presented at X-Ray Lasers and Coherent X-Ray Sources: Development and Applications XI, United States.DOI: 10.1117/12.2188166

Baksh, P., Odstrčil, M., Brocklesby, W., & Frey, J. (2015). XUV ptychographic imaging using a high harmonic source. Lasers for Science Facility User Meeting, United Kingdom.

Borkum, M. I., & Frey, J. G. (2014). Automatic completion of COSHH risk assessment forms using semantic representation of GHS and CLP regulation. 10th International Conference on Chemical Structures, Netherlands.

Odstrčil, M., Baksh, P., Frey, J. G., & Brocklesby, W. S. (2014). Coherent diffractive imaging with lower coherence laboratory sources. Poster session presented at Training School in Advanced X-Ray Spatial and Temporal Metrology, .

Willoughby, C., Frey, J. G., Coles, S. J., & Bird, C. (2014). Creating context for the experiment record: user-defined metadata. 247th ACS National Meeting & Exposition, United States.

Frey, J. G. (2014). Digital chemistry. ATLAS @ 50, United Kingdom.

Willoughby, C., & Frey, J. G. (2014). ELNs for researchers and students: a user perspective on ELNs in academic environments. EDKM Europe - ELNs, Data Analytics and Knowledge Management Summit 2014, Belgium.

Bird, C., Coles, S. J., Day, A., Frey, J. G., & Whitby, R. J. (2014). Extracting data, information, and knowledge from an ELN. 247th ACS National Meeting & Exposition, United States.

Frey, J. G. (2014). From open access to intelligently accessible data in Open Notebooks. Beyond Open Access, STM, United Kingdom.

Willoughby, C., Frey, J. G., Coles, S. J., & Coles, S. L. (2014). Generating metadata for an experiment: using a tablet ELN. 247th ACS National Meeting & Exposition, United States.

Frey, J. G. (2014). IT as a utility: reality, aspiration or myth. 7th IEEE/ACM International Conference on Utility and Cloud Computing, United Kingdom.

Frey, J. (2014). Jisc Digital Festival Panel on The Future of Research: are you ready?. Jisc Digital Festival, United Kingdom.

Willoughby, C., & Frey, J. G. (2014). Knowledge and memory: a study of what students remember about chemistry experiments. 247th ACS National Meeting & Exposition, United States.

Frey, J., & Borkum, M. (2014). Nomenclature and terminology - standards for materials and processes. Open Science, Open Data and Formulation: Realising the Benefits, United Kingdom.

Brewer, S., & Frey, J. (2014). Personal propensity profile for risk: me and my digital aura - P3fR. Paper presented at 7th ACM International Conference on Web Search and Data Mining (WSDM '14), United States.

Frey, J. G. (2014). Research data management. 9th International Digital Curation Conference, United States.

Frey, J. G., Coles, S. J., Bird, C. L., Milsted, A. J., & Robinson, J. (2014). Sample management with the LabTrove ELN. Paper presented at Conference, .

Parsons, A. D., Baksh, P., Brocklesby, W. S., Chapman, R. T., Mills, B., & Frey, J. G. (2013). Full characterisation of a focussed extreme ultraviolet beam using a non-redundant array of apertures. Poster session presented at CLEO/Europe-IQEC 2013, Germany.

Horak, P., Anderson, P. N., Butcher, T. J., Frey, J. G., & Brocklesby, W. S. (2013). High-power laser pulse compression for optimized high-harmonic generation in short hollow fibers. PIERS 2013, Sweden.

Anderson, P. N., Horak, P., Frey, J. G., & Brocklesby, W. S. (2013). Isolated attosecond pulses by self-compression in short gas-filled fibers. Poster session presented at CLEO-Europe/IQEC 2013, Germany.

Frey, J. (2013). Science ajar: how e-science can help (more) open science. SPRU Seminar Series, United Kingdom.

Parsons, A. D., Chapman, R. T., Mills, B., Bajt, S., Frey, J. G., & Brocklesby, W. S. (2013). Temporal coherence effects on coherent diffractive imaging of a binary sample by a high harmonic source. Paper presented at 18th International Conference on Ultrafast Phenomena, Switzerland.

Frey, J. G., Milsted, A. J., Coles, S. J., Bird, C. L., Willoughby, C., Neylon, C., & Todd, M. (2013). Towards a global open scientific notebook infrastructure. Research Data Access & Preservation Summit (RDAP13), United States.

Willoughby, C., Frey, J. G., Tonkin, E., Coles, S. J., & Bird, C. L. (2013). User perspectives of metadata use in electronic laboratory notebooks. Research Data Access & Preservation Summit (RDAP1), United States.

Frey, J. G. (2012). “Great expectations”: supporting inter-disciplinary, multi- disciplinary, and open collaborations. Scholarly outreach, impact and outcomes: The sixth UCL Bloomsbury conference, United Kingdom.

Frey, J. G. (2012). Digital and Physical Labs. Semantic Chemistry II, United States.

Anderson, P. N., Butcher, T. J., Horak, P., Frey, J. G., & Brocklesby, W. S. (2012). Few-cycle self-compression via multimode nonlinear optics in gas filled waveguides. Paper presented at CLEO/QELS 2012, United States.

Frey, J. G. (2012). Science Ajar: The Opportunities for Open Science. Transforming Opportunities in Scholarly Discourse, JISC/CNI Conference, United Kingdom.

Frey, J. G. (2012). Smart labs for smart people: joining physical, digital and personal spaces to facilitate research and learning. S-Lab Conference and Awards 2012, United Kingdom.

Boardman, R., Sinclair, I., Cox, S., Reed, P., Takeda, K., Frey, J., & Earl, G. (2012). Storage and sharing of large 3D imaging datasets. International Conference on 3D Materials Science 2012, United States.

Frey, J. G. (2012). The semantic web meets chemists wet and dry. OSCAT 2012 International Conference On Open Source for Computer - Aided Translational Medicine, India.

Parsons, A. D., Chapman, R. T., Mills, B., Butcher, T. J., Frey, J. G., & Brocklesby, W. S. (2011). 90 nm resolution reconstruction from a polychromatic signal using monochromatic phase retrieval techniques. Paper presented at European Conference on Lasers and Electro-Optics (CLEO/Europe-EQEC 2011), Germany.

Anderson, P. N., Butcher, T. J., Horak, P., Frey, J. G., & Brocklesby, W. S. (2011). Experimental demonstration of a high-flux capillary based XUV source in the high ionisation regime. Paper presented at Intense field, Short Wavelength Atomic and Molecular Processes (I-SWAMP 2011), Ireland.

Butcher, T. J., Anderson, P. N., Horak, P., Frey, J. G., & Brocklesby, W. S. (2011). High intensity pulse self-compression in short hollow core capillaries. Paper presented at European Conference on Lasers and Electro-Optics (CLEO/Europe-EQEC 2011), Germany.

Anderson, P., Butcher, T., Horak, P., Frey, J., & Brocklesby, W. S. (2011). High-flux capillary based XUV source via the direct engineering of a laser induced ionization profile. Poster session presented at The European Conference on Lasers and Electro-Optics (CLEO/Europe), Germany.

Borkum, M., Lagoze, C., Frey, J., & Coles, S. (2010). A semantic eScience platform for chemistry. In 2010 IEEE Sixth International Conference on e-Science. (pp. 316-323). Piscataway, United States: Institute of Electrical and Electronics Engineers. DOI: 10.1109/eScience.2010.18

Blower, J. D., Santokhee, A., Milsted, A. J., & Frey, J. G. (2010). BlogMyData: a Virtual Research Environment for collaborative visualization of environmental data. Paper presented at All Hands Meeting 2010, United Kingdom.

Takeda, K., Brown, M., Coles, S., Carr, L., Earl, G., Frey, J., ... Patterson, S. (2010). Data management for all: the Institutional Data Management Blueprint Project. Paper presented at 6th International Digital Curation Conference, United States.

Frey, J. G. (2010). Imaging x-ray generation and scattering: tabletop soft x-ray coherent imaging microscopes. The Working Group Meeting of the COST Action MP0601, Short Wavelength Laboratory Sources, t, Poland.

Grant-Jacob, J., Mills, B., Butcher, T. J., Chapman, R. T., Brocklesby, W. S., & Frey, J. G. (2010). Influence of gas jet structure on high harmonic generation. Paper presented at Photon 10, United Kingdom.

Frey, J. G. (2010). Smart labs for smart people – new ways to collect, curate and share information. In K. Tuominen (Ed.), Proceedings of VTT 2010 ICSTI's (International Council for Scientific and Technical Information) Annual Conference 2010: from Information to Innovation. (pp. 115-132). (VTT Symposium; No. 267). International Council for Scientific and Technical Information.

Butcher, T. J., Chapman, R. T., Horak, P., Poletti, F., Frey, J. G., & Brocklesby, W. S. (2010). Spatio-spectral technique to verify pump-pulse propagation model in an Ar-filled capillary in the presence of high harmonic generation. Paper presented at Photon 10, United Kingdom.

King, W., Greef, R., Byfield, V., Ermakov, S., & Frey, J. G. (2009). Characterisation of the sea surface microlayer - using Langmuir films and ellipsometry. Poster session presented at Canadian Meterological and Oceanographic Society 2009 Congress, .

Wilson, S., Milsted, A. J., & Frey, J. G. (2009). Comment by sketch: a picture says a million words. Microsoft eScience Workshop 2009, United States.

Wilson, S., & Frey, J. G. (2009). Critical zone observatories and sensor repositories. UK e-Science All Hands Meeting (AHM 2009), United Kingdom.

Wilson, S., & Frey, J. G. (2009). Critical zone observatories and sensor repositories. Poster session presented at Microsoft eScience Workshop 2009, United Kingdom.

Hudec, R., Mills, B., Rogers, E. T. F., Grant-Jacob, J., Stebbings, S. L., Praeger, M., ... Pina, L. (2009). EUV off-axis focusing using a high harmonic source. Paper presented at SPIE Europe Conference on EUV and X-Ray Optics - Synergy between Laboratory and Space/Optics + Optoelectronics Symposium, Czech Republic.DOI: 10.1117/12.820682

Borkum, M., Coles, S. J., & Frey, J. G. (2009). Integration of oreChem with the eCrystals repository for crystal structures. Paper presented at 9th UK e-Science All Hands Meeting, United Kingdom.

Frey, J. G. (2009). Logs, blogs and pods: smart electronic laboratory notebooks. e-Research Open Meeting 2009, .

Mills, B., Rogers, E. T. F., Grant-Jacob, J., Butcher, T., Stebbings, S., Brocklesby, W. S., ... Frey, J. (2009). Nanomaterial structure determination using XUV diffraction. Paper presented at 2nd European Topical Meeting on Nanophotonics and Metamaterials (NanoMeta), .

Horak, P., Chapman, R. T., Poletti, F., Frey, J. G., & Brocklesby, W. S. (2009). Nonlinear optical mode coupling by ionization in an Ar-filled capillary with high-power short-pulse excitation. Paper presented at European Conference on Lasers and Electro-Optics (CLEO/Europe-EQEC), .

Stephen, W., Frey, J. G., & Coles, S. J. (2009). Second Life: The next virtual laboratory?. UK e-Science All Hands Meeting (AHM 2009), United Kingdom.

Mills, B., Chau, C. F., Rogers, E. T. F., Grant-Jacob, J., Stebbings, S. L., Praeger, M., ... Frey, J. G. (2009). Simultaneous measurement of structure and XUF dielectric constant of nanoscale objects using diffraction of high harmonic radiation. Paper presented at Conference on Lasers and Electro-Optics (CLEO/IQEC 2009), .

Wilson, S., Birch, O., & Frey, J. G. (2009). The LEGO laboratory: laser induced fluorescence. Poster session presented at UK e-Science All Hands Meeting (AHM 2009), United Kingdom.

Wilson, S., & Frey, J. (2009). The smartlab: experimental and environmental control and monitoring of the chemistry laboratory. The 2009 International Symposium on Collaborative Technologies and Systems (CTS 2009), United States.

Wilson, S., & Frey, J. G. (2009). The SmartLab: Real-Time Monitoring and Control in the Chemistry Laboratory. Paper presented at School of Chemistry Postgraduate poster session 2009, .

Wilson, S., & Frey, J. G. (2009). Web tools, mashups and automated lasers. Poster session presented at UK e-Science All Hands Meeting (AHM 2009), United Kingdom.

Mills, B., Chau, C. F., Rogers, E. T. F., Grant-Jacob, J., Stebbings, S. L., Praeger, M., ... Frey, J. G. (2008). XUV diffraction from a self-assembled 2D array of close-packed 200nm diameter PMMA spheres. Paper presented at European Conference on X-Ray Spectrometry (EXRS), Croatia.

Stebbings, S. L., Rogers, E. T. F., de Paula, A. M., Praeger, M., Froud, C. A., Mills, B., ... Frey, J. G. (2007). Molecular control of the evolution of capillary-generated soft X-ray high harmonics. Paper presented at CLEO/QELS 2007, .

Frey, J. G. (2007). Science as a collaborative process - the Scholarly Knowledge Cycle and Blogging the Laboratory (Smartlab 2.5?). Web 2.0 and Grids Workshop at OGF19, .

Frey, J. G., Gledhill, R. J., Milsted, A., Kent, S., Essex, J. W., & Richards, G. W. (2006). A computer-aided drug discovery system for chemistry teaching. American Chemical Society 232 National Meeting, .

Woods, D. C., Grove, D. M., Liccardi, I., Lewis, S. M., & Frey, J. G. (2006). An eLearning website for the design and analysis of experiments with application to chemical processes. In A. Rizzi, & M. Vichi (Eds.), COMPSTAT 2006: Proceedings In Computational Statistics. (pp. 1641-1649). Heidelberg: Physica-Verlag.

Frey, J. G., & De Roure, D. (2006). CombeChem. EPRSC Final Report Presentations and Interview, .

Frey, J., De Roure, D., Taylor, K., Essex, J., Mills, H., & Zaluska, E. (2006). CombeChem: a case study in provenance and annotation using the Semantic Web. In L. Moreau, & I. Foster (Eds.), Provenance and Annotation of Data. (pp. 270-277). (Lecture Notes in Computer Science; Vol. 4145/2006). Berlin, Germany: Springer. DOI: 10.1007/11890850_27

Frey, J. G. (2006). CombeChem: semantic support for the chemical information life cycle. American Chemical Society 232 National Meeting, .

Coles, S., Frey, J., & Milsted, A. (2006). Curation of chemistry from laboratory to publication: “The curation of laboratory experimental data as part of the overall data lifecycle”. 185-192. Paper presented at UK e-Science All Hands Meeting 2006, .

Frey, J. G. (2006). ELN in the semantic era. IBC Life Science Conference Maximising the Potential of Electronic Laboratory Notebooks, A journey from planning to implementation and beyond, .

Coles, S. J., Frey, J. G., Hursthouse, M. B., Milsted, A. J., Carr, L. A., Gutteridge, C. J., ... Day, M. (2006). Enabling the reusability of scientific data: Experiences with designing an open access infrastructure for sharing datasets.. Paper presented at Designing for Usability in e-Science, .

Coles, S. J., Frey, J. G., Hursthouse, M. B., De Roure, D., Mills, H. R., & Meacham, K. E. (2006). Experiences in deploying a useable Grid-enabled service for the National Crystallography Service. Paper presented at Designing for Usability in e-Science, .

Frey, J. G. (2006). Free The Data. WWW 2006 Panel Discussion, .

Frey, J. G. (2006). Future Lab - "Smart not Dark". Smart Lab: Laboratory Informatics Exchange, .

Frey, J. G. (2006). Future Lab - "Smart Not Dark". Bright Sparks - Blue Fusion Event, .

Frey, J. G. (2006). Future Lab - 'Smart Not Dark'. Smart Lab: Laboratory Informatics Exchange, .

Frey, J. G. (2006). Future Lab: Smart Not Dark. IBM Hursley Technical Exchange, .

Praeger, M., de Paula, A. M., Stebbings, S. L., Froud, C. A., Rogers, E. T. F., Brocklesby, W. S., ... Frey, J. G. (2006). Microscale diffraction measurements with a high harmonic soft X-ray source. Paper presented at Conference on Lasers and Electro-Optics (CLEO) and The International Quantum Electronics Conference (IQEC): CLEO/IQEC 2006, .

Frey, J. G. (2006). Physical Science Research Spaces: Key issues for science researchers. Exploring Research Space Workshop, .

Frey, J. G., Gledhill, R., Kent, S., Hudson, B., & Essex, J. (2006). Schools Malaria Project. In Proceedings of the UK e-Science All Hands Meeting 2005. (UK e-Science All Hands Meeting; No. 2005). UK: Engineering and Physical Science Research Council.

Robinson, J. M., Frey, J. G., De Roure, D. C., Stanford-Clark, A. J., Reynolds, A. D., Bedi, B. V., & Conway-Jones, D. (2006). The Combechem MQTT LEGO microscope: a grid enabled scientific apparatus demonstrator. In Proceedings of the Fifth All Hands Meeting. (pp. 393-396). UK: National eScience Center.

Frey, J. G. (2006). The curation of laboratory experimental data as part of the overall data lifecycle. Paper presented at 2nd International Digital Curation Conference, .

Froud, C., de Paula, A. M., Rogers, E. T., Stebbings, S. L., Brocklesby, W. S., Baumberg, J. J., ... Nolte, S. (Ed.) (2006). Towards single molecule shape determination with laser generated soft X-rays. American Chemical Society 232 National Meeting, .

Robinson, J. M., Frey, J. G., Stanford-Clark, A. J., Reynolds, A. D., & Bedi, B. V. (2005). Chemistry by Mobile Phone (or how to justify more time at the bar). Paper presented at UK e-Science All Hands Meeting 2005, .

Frey, J. G., Bird, C., Todd, S., Attard, G., Goodson, K., Burt, R., & Beynon, M. (2005). Cross-disciplinarity: Benefits and Opportunities. IBM & School of Chemistry Talks Series 4, .

Praeger, M., Brocklesby, W. S., de Paula, A. M., Frey, J., Baumberg, J. J., Netti, C. M., ... Lincoln, J. R. (2005). Generalised ultrafast dispersion scans of continuum generation induced by sub-50fs chirped pulses in highly nonlinear tapered planar waveguides. Paper presented at SPIE 5714 : Commercial and Biomedical Applications of Ultrafast Lasers V, .DOI: 10.1117/12.589346

Coles, S., Frey, J. G., Peppe, S., Hursthouse, M., Light, M., Surridge, M., ... Zaluska, E. (2005). Grid-Enabling an Existing Instument-Based National Service. In H. Stockinger, R. Buyya, & R. Perrott (Eds.), Proceedings e-Science and Grid Computing 2005. (pp. 570-577). (e-Science and Grid Computing; Vol. 1st, No. 1). USA: IEEE Computer Society.

Praeger, M., de Paula, A. M., Baumberg, J. J., Froud, C. A., Rogers, E. T. F., Hanna, D. C., ... Frey, J. G. (2005). Nanoscale X-ray source by high harmonic generation in a capillary. 1-26. Micro and Nanotechnology 2005 (MNT 05) International Conference, .

Frey, J. G. (2004). Automation and semantics: the CombeChem experience. International Informatics and Data Visualisation Conference, .

schraefel, M., Hughes, G., Mills, H., Smith, G., Payne, T., & Frey, J. (2004). Breaking the book: translating the chemistry lab book into a pervasive computing lab environment. In Proceedings of CHI 2004. Wien, AT: CHI.

Bachler, M., Buckingham-Shum, S., Chen-Burger, J., Dalton, J., De Roure, D., Eisenstadt, M., ... Tate, A. (2004). Chain ReAKTing: Collaborative Advanced Knowledge Technologies in the CombeChem Grid. In S. Cox (Ed.), Proceedings of the UK e-Science All Hands Meeting, Nottingham, Sep 2003. (pp. (6pp)). Swindon, UK: EPSRC.

Coles, S. J., Frey, J. G., Hursthouse, M. B., Carr, L. A., & Gutteridge, C. J. (2004). Crystal Structure EPrints: Publication @ Source Through the Open Archive Initiative. Poster session presented at British Crystallography Association Spring Meeting 2004, .

Coles, S., Frey, J., Hursthouse, M., Carr, L., & Gutteridge, C. (2004). Crystallographic ePrints. EPSRC eScience Testbed projects meeting, .

Robinson, J. M., Frey, J. G., Danos, L., & Fu, H. (2004). Design of grid computing infrastructure to aid second harmonic generation studies at the liquid/air interface. Poster session presented at Chemical Physics: Perspectives and Prospects for the Future, .

Frey, J., Reynolds, A., Roberts, M., Legg, S., Jones, N., Glover-Gunn, M., & IBM UK Laboratories (2004). Does science need computer science?. IBM Hursley Talks, Series 3, .

Coles, S., Lyon, L., Carr, L., Heery, R., Hursthouse, M., Gutteridge, C., ... De Roure, D. (2004). eBank UK linking research data, scholarly communication and learning. Paper presented at Semantic Grid Workshop: Global Grid Forum 11, .

Lyon, L., Heery, R., Duke, M., Coles, S. J., Frey, J. G., Hursthouse, M. B., ... Gutteridge, C. J. (2004). eBank UK: linking research data, scholarly communication and learning. In eScience All Hands Meeting. Swindon, UK: Engineering and Physical Sciences Research Council.

Coles, S. J., Hursthouse, M. B., Frey, J. G., Carr, L. A., & Gutteridge, C. J. (2004). eCrystallographyDataReports: an open archive route for the reporting and dissemination of crystal structures. Poster session presented at International Symposium on Supramolecular Chemistry XIII, .

Robinson, J., Grove, D., Lewis, S., Manson, R., Frey, J., Essex, J., ... Parry, P. (2004). eTechniques for Teaching. EPSRC eScience Testbed projects meeting, .

Frey, J. G. (2004). Experiments on the Grid: the UK National Crystalography Service. 227th ACS National Meeting, .

Frey, J. G., & Hursthouse, M. B. (2004). From e-Science to Publication@Source. National Policies on Open Access (OA) Provision for University Research Output, .

Heery, R., Duke, M., Day, M., Lyon, L., Hursthouse, M. B., Frey, J. G., ... Carr, L. A. (2004). Integrating research data into the publication workflow: the eBank UK experience. Paper presented at PV-2004: Ensuring the Long-Term Preservation and Adding Value to the Scientific and Technical Data, .

Frey, J. G., Hughes, G. V., Mill, H. R., schraefel, M., Smith, G. M., & De Roure, D. (2004). Less is More: Lightweight Ontologies and User Interfaces for Smart Labs. In S. Cox (Ed.), Proceedings of the UK e- Science All Hands Meeting, Nottingham, Sep 2003. (pp. (8pp)). Swindon, UK: EPSRC.

Frey, J. G., Bradley, M., Kress, J., Rose, A., & Stanford, H. (2004). Looking inside solid supports: Confocal Raman Microscopy of polymer beads. FACSS 2004 (Federation of Analytical Chemistry and Spectroscopy Societies), .

Frey, J., Hughes, G. V., Mills, H. R., Payne, T. R., schraefel, M., & Smith, G. M. (2004). Making tea: a human centred approach to designing a pervasive smart lab notebook. 227th ACS National Meeting, .

schraefel, M., Hughes, G., Mills, H., Smith, G., & Frey, J. (2004). Making tea: iterative design through analogy. In Proceedings of Designing Interactive Systems. (pp. 1-10). Cambridge, USA: Association for Computing Machinery.

Meacham, K., Surridge, M., Taylor, S., Coles, S., Light, M., Bingham, A., ... Mills, H. (2004). National Crystallography Service (NCS) Grid Service. EPSRC eScience Testbed projects meeting, .

Sono, T. J., Danos, L., Frey, J., Scott, J. G., Mailis, S., & Eason, R. W. (2004). Second harmonic generation (SHG) via reflection from +z and -z faces of a z-cut LiNbO3 crystal. Paper presented at Chemical Physics Conference: Perspective and Prospects for the Future, .

Fu, H., & Frey, J. G. (2004). Semantic description and tracking of analysis of chemical data. In H. Zhuge, W. K. Cheung, & J. Liu (Eds.), Proceedings of the Second International Workshop on the Knowledge Grid and Grid Intelligence (KGGI 2004). Beijing, China: China Knowledge Grid Research Group.

Welsh, A., Mansson, R., Danos, L., Frey, J., & Essex, J. (2004). Statistical Model Fitting. EPSRC eScience Pilot Project Meeting, .

Woods, C. J., Frey, J. G., & Essex, J. W. (2004). The Application of Distributed Computing to the Investigation of Protein Conformational Change. In S. Cox (Ed.), Proceedings of the UK e-Science All Hands Meeting, Sep 2003. (pp. (6pp)). Swindon, UK: EPSRC.

Frey, J. G. (2003). Comb-e-Chem: an e-science research project. In M. Ford, D. Livingstone, J. Dearden, & H. Van der Waterbeemd (Eds.), EuroQSAR 2002 Designing Drugs and Crop Protectants: processes, problems and solutions. (pp. 395-398). (European Symposium on QSAR; Vol. 14th). Oxford, UK: Blackwell.

Frey, J. G., De Roure, D., schraefel, M., Mills, H., Fu, H., Peppe, S., ... Payne, T. R. (2003). Context Slicing the Chemical Aether. In D. Millard (Ed.), Proceedings of First International Workshop on Hypermedia and the Semantic Web. (pp. (9pp)). Nottingham, UK: University of Nottingham.

Mansson, R. A., Welsh, A. H., Frey, J. G., & Danos, L. (2003). Designing experiments for an application in laser and surface Chemistry. Poster session presented at Conference on New Directions in Experimental Design DAE 2003, .

Coles, S. J., Frey, J. G., Hursthouse, M. B., Light, M. E., DeRoure, D. C., Mills, H. R., ... Taylor, S. J. (2003). The EPSRC National Crystallography Service in the 21st century: A new dimension!. Poster session presented at British Crystallography Association Spring Meeting 2003, .

Frey, J. G. (2003). The impact of e-Science. 2003 CBI Society Annual Meeting: New Frontiers for Chem-Bio Informatics, .

Coles, S. J., Frey, J. G., Hursthouse, M. B., Light, M. E., Surridge, M., Meacham, K. E., ... Mills, H. R. (2002). Grid/Web enhancements to the National Crystallographic Service: experiences with an interactive e-Science demonstrator. In F. R. A. Hopgood, B. Matthews, & M. D. Wilson (Eds.), Euroweb 2002 - the Web and the GRID: from e-Science to e-Business , Oxford, UK, 17-18 December 2002. (Electronic Workshops in Computing). Swindon, UK: British Computer Society.

Reports

Frey, J. G., Bird, C., & Willoughby, C. (2012). Diverse perceptions of smart spaces. Southampton, GB: University of Southampton.

Read, D., Coles, S. J., Frey, J. G., & Littlefield, B. T. R. (2012). Investigating the use of Virtual Learning Environments by teachers in schools and colleges. David Read.

Brown, M., White, W., Takeda, K., Coles, S., Carr, L., Earl, G., ... Styles, C. (2011). Institutional data management blueprint final report. Southampton, GB: University of Southampton.

Bicarregui, J., Boulderstone, R., Estelle, L., Frey, J., Jacobs, N., Kilbride, W., ... Office of Science and Technology, e-Infrastructure Steering Group (2006). 20/20 Vision: an e-Infrastructure for the next decade. Report of the Data and Information Creation Working Group to the e-Infrastructure Steering Group. London, UK: Office of Science and Technology.

Borda, A., Careless, J., Dimitrova, M., Fraser, M., Frey, J., Hubbard, P., ... Office of Science and Technology, e-Infrastructure Steering Group (2006). Report of the Working Group on Virtual Research Communities for the OST e-Infrastructure Steering Group. London, UK: Office of Science and Technology.

McNamara, C. A., Woods, D. C., Lewis, S. M., Bradley, M., & Frey, J. G. (2005). Optimization of asymmetric dihydroxylation through optimal designed experiments. (School of Mathematics Technical Report; No. 386). Southampton, UK: University of Southampton, School of Mathematics.

Coles, S. J., Frey, J., DeRoure, D., & Hursthouse, M. (2004). The CrystalGrid Collaboratory Foundation Workshop, Southampton, 13-17 September, 2004: a selection of presentations. Southampton: University of Southampton, School of Chemistry.

Year 1 Lecturer in Environmental Chemistry (CHEM 1008)

Year 2 Lecturer and Coordinator for Equilibrium and Change (CHEM 2012)

Year 3 Module coordinator for and contributor to the Year 3 Atmospheric Chemistry (CHEM 3036)

Year 4 Data Intensive Science (CHEM 6128)

Coordinator and contributor to Year 3 distance learning CHEM 3025 (Phys. Chem.)

Year 3 and Year 4 Project supervisor

Year 2/Year 3 and Year 4 Summer intern projects

Professor Jeremy G Frey
Chemistry University of Southampton Highfield Southampton SO17 1BJ

Room Number:27/2029

Telephone:(023) 8059 3209
Facsimile:(023) 8059 3781
Email:J.G.Frey@soton.ac.uk

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