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  1. Software › Research

  2. public beta version of interactive ternary graph tool

    Sebald, A. A-M., Tomasello, L. & Mitchell, D. A., 28 Jun 2017

    Research output: Non-textual form › Software

  3. public beta version of maxfacts.uk

    Sebald, A. A-M., Tomasello, L. & Mitchell, D. A., 28 Jun 2017

    Research output: Non-textual form › Software

  4. Web publication/site › Research

  5. Maxfacts self-help videos guide cancer patients through basic physio

    Sebald, A. A-M. & Mellor, L., 24 Jul 2017

    Research output: Non-textual form › Web publication/site

  6. Maxfacts.uk

    Sebald, A. A-M., Tomasello, L. & Mitchell, D. A., 28 Jun 2017

    Research output: Non-textual form › Web publication/site

  7. Article › Research › Not peer-reviewed

  8. A meteorological and chemical overview of the DACCIWA field campaign in West Africa in June--July 2016

    Knippertz, P., Fink, A. H., Deroubaix, A., Morris, E., Tocquer, F., Evans, M. J., Flamant, C., Gaetani, M., Lavaysse, C., Mari, C., Marsham, J. H., Meynadier, R., Affo-Dogo, A., Bahaga, T., Brosse, F., Deetz, K., Guebsi, R., Latifou, I., Maranan, M., Rosenberg, P. D. & 1 othersSchlueter, A., 4 May 2017

    Article in Atmospheric Chemistry and Physics Discussions

  9. A self-consistent, multi-variate method for the determination of gas phase rate coefficients, applied to reactions of atmospheric VOCs and the hydroxyl radical

    Shaw, J. T., Lidster, R. T., Cryer, D. R., Ramirez, N., Bousted, G., Whalley, L. K., Ingham, T., Rickard, A. R., Dunmore, R. E., Heard, D. E., Lewis, A., Carpenter, L. J., Hamilton, J. F. & Dillon, T. J., 6 Oct 2017

    Article in Atmospheric Chemistry and Physics Discussions

  10. BrO and Bry profiles over the Western Pacific: Relevance of Inorganic Bromine Sources and a Bry Minimum in the Aged Tropical Tropopause Layer

    Koenig, T. K., Volkamer, R., Baidar, S., Dix, B., Anderson, D. C., Salawitch, R. J., Wales, P. A., Cuevas, C. A., Fernandez, R. P., Saiz-Lopez, A., Evans, M. J., Sherwen, T., Jacob, D. J., Schmidt, J., Kinnison, D., Lamarque, J-F., Apel, E. C., Bresch, J. C., Campos, T., Flocke, F. M. & 22 othersHonomichl, S. B., Hornbrook, R., Jensen, J. B., Lueb, R., Montzka, D. D., Pan, L. L., Reeves, J. M., Schauffler, S. M., Ullmann, K., Weinheimer, A. J., Atlas, E. L., Donets, V., Navarro, M. A., Riemer, D., Blake, N. J., Huey, L. G., Tanner, D. J., Hanisco, T. F., Wolfe, G. M., Wang, S., Chen, D. & Hall, S. R., 7 Jul 2017

    Article in Atmospheric Chemistry and Physics Discussions

  11. Evaluation of a low-cost optical particle counter (Alphasense OPC-N2) for ambient air monitoring

    Crilley, L. R., Shaw, M. D., Pound, R. J., Kramer, L. J., Price, R., Young, S., Lewis, A. & Pope, F., 31 Aug 2017

    Article in Atmospheric Measurement Techniques Discussions

  12. Importance of reactive halogens in the tropical marine atmosphere: A regional modelling study using WRF-Chem

    Badia, A., Reeves, C. E., Baker, A. R., Saiz-Lopez, A., Volkamer, R., Apel, E. C., Hornbrook, R. S., Carpenter, L. J., Andrews, S. J., Sherwen, T. & von Glasow, R., 1 Nov 2017

    Article in Atmospheric Chemistry and Physics Discussions

  13. The atmospheric impacts of monoterpene ozonolysis on global stabilised Criegee intermediate budgets and SO2 oxidation: experiment, theory and modelling

    Newland, M. J., Rickard, A. R., Sherwen, T., Evans, M. J., Vereecken, L., Muñoz, A., Ródenas, M. & Bloss, W. J., 5 Dec 2017

    Article in Atmospheric Chemistry and Physics Discussions

  14. Article › Research › Peer-reviewed

  15. 1,6-Cyclophellitol Cyclosulfates: A New Class of Irreversible Glycosidase Inhibitor

    Artola, M., Wu, L., Ferraz, M. J., Kuo, C. L., Raich, L., Breen, I. Z., Offen, W. A., Codée, J. D. C., Van Der Marel, G. A., Rovira, C., Aerts, J. M. F. G., Davies, G. J. & Overkleeft, H. S., 26 Jul 2017

    Article in ACS Central Science

  16. 2,2,5,5-Tetramethyltetrahydrofuran (TMTHF): A non-polar, non-peroxide forming ether replacement for hazardous hydrocarbon solvents

    Byrne, F., Forier, B., Bossaert, G., Hoebers, C., Farmer, T. J., Clark, J. H. & Hunt, A. J., 7 Aug 2017

    Article in Green Chemistry

  17. 2D-IR spectroscopy shows that optimized DNA minor groove binding of Hoechst33258 follows an induced fit model

    Ramakers, L. A. I., Hithell, G., May, J. J., Greetham, G. M., Donaldson, P. M., Towrie, M., Parker, A. W., Burley, G. A. & Hunt, N. T., 19 Jan 2017

    Article in Journal of Physical Chemistry B

  18. A Cu-Catalysed Radical Cross-Dehydrogenative Coupling Approach to Acridanes and Related Heterocycles

    Hurst, T. E. & Taylor, R. J. K., 3 Jan 2017

    Article in European Journal of Organic Chemistry

  19. A Fluorescence Polarization Activity-Based Protein Profiling Assay in the Discovery of Potent, Selective Inhibitors for Human Nonlysosomal Glucosylceramidase

    Lahav, D., Liu, B., van den Berg, R. J. B. H. N., van den Nieuwendijk, A. M. C. H., Wennekes, T., Ghisaidoobe, A. T., Breen, I., Ferraz, M. J., Kuo, C-L., Wu, L., Geurink, P. P., Ovaa, H., van der Marel, G. A., van der Stelt, M., Boot, R. G., Davies, G. J., Aerts, J. M. F. G. & Overkleeft, H. S., 11 Oct 2017

    Article in Journal of the American Chemical Society

  20. A Low-Temperature, Transition Metal-Free Cross Dehydrogenative Coupling Protocol for the Synthesis of 3,3-Disubstituted Oxindoles

    Donald, J. R., Taylor, R. J. K. & Petersen, W. F., 19 Sep 2017

    Article in The Journal of organic chemistry

  21. A Nematic to Nematic Transformation Exhibited by a Rod-Like Liquid Crystal

    Mandle, R., Cowling, S. J. & Goodby, J. W., 14 May 2017

    Article in Physical Chemistry Chemical Physics

  22. A Simple Route to Strong Carbon-13 NMR Signals Detectable for Several Minutes

    Roy, S. S., Norcott, P., Rayner, P. J., Green, G. G. R. & Duckett, S. B., 19 Jul 2017

    Article in Chemistry : A European Journal

  23. A Specific Activity-Based Probe to Monitor Family GH59 Galactosylceramidase, the Enzyme Deficient in Krabbe Disease

    Marques, A. R. A., Willems, L. I., Herrera Moro, D., Florea, B. I., Scheij, S., Ottenhoff, R., van Roomen, C. P. A. A., Verhoek, M., Nelson, J. K., Kallemeijn, W. W., Biela-Banas, A., Martin, O. R., Cachón‐González, M. B., Kim, N. N., Cox, T. M., Boot, R. G., Overkleeft, H. S. & Aerts, J. M. F. G., 31 Jan 2017

    Article in Chembiochem

  24. A Two-Step Synthesis of 2-Spiropiperidines

    Griggs, S. D., Thompson, N., Tape, D. T., Fabre, M. & Clarke, P. A., 12 Jul 2017

    Article in Chemistry : A European Journal

  25. A mechanistic study of the Lewis acid-Brønsted base-Brønsted acid catalysed asymmetric Michael addition of diethyl malonate to cyclohexenone

    Samoilichenko, Y., Kondratenko, V., Ezernitskaya, M., Lyssenko, K., Peregudov, A., Khrustalev, V., Maleev, V., Moskalenko, M., North, M., Tsaloev, A., Gugkaeva, Z. T. & Belokon, Y., 7 Jan 2017

    Article in Catalysis Science and Technology

  26. A new diagnostic for tropospheric ozone production

    Edwards, P. M. & Evans, M. J., 17 Nov 2017

    Article in Atmospheric Chemistry and Physics

  27. A nocturnal atmospheric loss of CH2I2 in the remote marine boundary layer

    Carpenter, L. J., Andrews, S. J., Lidster, R. T., Saiz-Lopez, A., Fernandez-Sanchez, M., Bloss, W. J., Ouyang, B. & Jones, R. L., Jun 2017

    Article in Journal of Atmospheric Chemistry

  28. A novel automated rodent tracker (ART), demonstrated in a mouse model of amyotrophic lateral sclerosis

    Hewitt, B. M., Yap, M. H., Hodson-Tole, E. F., Kennerley, A. J., Sharp, P. S. & Grant, R. A., 13 Apr 2017

    Article in Journal of Neuroscience Methods

  29. A novel stibacarbaborane cluster with adjacent antimony atoms exhibiting unique pnictogen bond formation that dominates its crystal packing

    Holub, J., Melichar, P., Růžičková, Z., Vrána, J., Wann, D. A., Fanfrlík, J., Hnyk, D. & Růžička, A., 2017

    Article in Dalton Transactions

  30. A reductive aminase from Aspergillus oryzae

    Aleku, G., France, S., Man, H. W-H., Mangas-Sanchez, J., Montgomery, S. L., Sharma, M., Leipold, F., Hussain, S., Grogan, G. J. & Turner, N., 1 Oct 2017

    Article in Nature Chemistry

  31. A structurally characterised fluoroalkyne

    Hall, L. M., Tew, D., Pridmore, N. E., Whitwood, A. C., Lynam, J. M. & Slattery, J. M., 19 Jun 2017

    Article in Angewandte Chemie International Edition

  32. A widespread family of serine/threonine protein phosphatases shares a common regulatory switch with proteasomal proteases

    Bradshaw, N., Levdikov, V. M., Zimanyi, C. M., Gaudet, R., Wilkinson, A. J. & Losick, R., 12 Jun 2017

    Article in eLife

  33. ARE EXPOSURE PREDICTIONS, USED FOR THE PRIORITISATION OF PHARMACEUTICALS IN THE ENVIRONMENT, FIT FOR PURPOSE?

    Burns, E. E., Thomas-Oates, J., Kolpin, D. W., Furlong, E. T. & Boxall, A. B. A., 6 May 2017

    Article in Environmental Toxicology and Chemistry

  34. Access to Some C5-Cyclised 2-Pyrones and 2-Pyridones via Direct Arylation; Retention of Chloride as a Synthetic Handle

    Prendergast, A. M., Pardo, L. M., Fairlamb, I. J. S. & McGlacken, G. P., 13 Sep 2017

    Article in European Journal of Organic Chemistry

  35. Accurate Representations of the Physicochemical Properties of Atmospheric Aerosols: When are Laboratory Measurements of Value?

    Marsh, A., Rovelli, G., Song, Y-C., Pereira, K. L., Willoughby, R., Bzdek, B., Hamilton, J. F., Orr-Ewing, A., Topping, D. & Jonathan, R., 27 Jan 2017

    Article in Faraday Discuss.

  36. Achieving Biocompatible SABRE: An in vitro Cytotoxicity Study

    Manoharan, A., Rayner, P. J., Iali, W., Burns, M. J., Perry, V. H. & Duckett, S. B., 12 Dec 2017

    Article in CHEMMEDCHEM

  37. Achieving High 1H Nuclear Hyperpolarization Levels with Long Lifetimes in a Range of Tuberculosis Drug Scaffolds

    Norcott, P., Rayner, P. J., Green, G. G. R. & Duckett, S. B., 1 Dec 2017

    Article in Chemistry : A European Journal

  38. Achieving High Levels of NMR-Hyperpolarization in Aqueous Media With Minimal Catalyst Contamination via SABRE

    Iali, W., Olaru, A. M., Green, G. G. R. & Duckett, S. B., 19 Jul 2017

    Article in Chemistry : A European Journal

  39. Activity-based probes for functional interrogation of retaining β-glucuronidases

    Wu, L., Jiang, J., Jin, Y., Kallemeijn, W. W., Kuo, C. L., Artola, M., Dai, W., Van Elk, C., Van Eijk, M., Van Der Marel, G. A., Codée, J. D. C., Florea, B. I., Aerts, J. M. F. G., Overkleeft, H. S. & Davies, G. J., 1 Aug 2017

    Article in NATURE CHEMICAL BIOLOGY

  40. Aerobic oxidation of benzyl alcohols to benzaldehydes using monoclinic bismuth vanadate nanoparticles under visible light irradiation: Photocatalysis selectivity and inhibition

    Unsworth, C. A., Coulson, B., Chechik, V. & Douthwaite, R. E., 1 Oct 2017

    Article in Journal of Catalysis

  41. All-inorganic perovskite-based distributed feedback resonator

    Gong, J., Wang, Y., Liu, S., Zeng, P., Yang, X., Liang, R., Ou, Q., Wu, X. & Zhang, S., 27 Nov 2017

    Article in Optics Express

  42. Amylose recognition and ring-size determination of amylomaltase

    Roth, C., Weizenmann, N., Bexten, N., Saenger, W., Zimmermann, W., Maier, T. & Sträter, N., 13 Jan 2017

    Article in Science Advances

  43. An S-Oxygenated [NiFe] Complex Modelling Sulfenate Intermediates of an O2-Tolerant Hydrogenase

    Lindenmaier, N. J., Wahlefeld, S., Bill, E., Szilvási, T., Eberle, C., Yao, S., Hildebrandt, P., Horch, M., Zebger, I. & Driess, M., 1 Jan 2017

    Article in Angewandte Chemie - International Edition

  44. An allosteric transport mechanism for the AcrAB-TolC multidrug efflux pump

    Wang, Z., Fan, G., Hryc, C. F., Blaza, J. N., Serysheva, I. I., Schmid, M. F., Chiu, W., Luisi, B. F. & Du, D., 29 Mar 2017

    Article in eLife

  45. An atypical interaction explains the high-affinity of a non-hydrolyzable S-linked 1,6-α-mannanase inhibitor

    Belz, T., Jin, Y., Coines, J., Rovira, C., Davies, G. J. & Williams, S. J., 25 Aug 2017

    Article in Chemical Communications

  46. An evaluation of credentials of a multicomponent reaction for the synthesis of isothioureas through the use of a holistic CHEM21 green metrics toolkit

    Abou-Shehada, S., Mampuys, P., Maes, B. U. W., Clark, J. H. & Summerton, L., 7 Jan 2017

    Article in Green Chemistry

  47. Analysis of HypD Disulfide Redox Chemistry via Optimization of Fourier Transformed ac Voltammetric Data

    Adamson, H., Robinson, M., Bond, P. S., Soboh, B., Gillow, K., Simonov, A. N., Elton, D. M., Bond, A. M., Sawers, R. G., Gavaghan, D. J. & Parkin, A., 7 Feb 2017

    Article in Analytical Chemistry

  48. Analysis of biogenic carbonyl compounds in rainwater by stir bar sorptive extraction technique with chemical derivatization and gas chromatography-mass spectrometry

    Pang, X., Lewis, A. C. & Shaw, M. D., 1 Feb 2017

    Article in JOURNAL OF SEPARATION SCIENCE

  49. Assessing recent warming using instrumentally homogeneous sea surface temperature records

    Hausfather, Z., Cowtan, K., Clarke, D. C., Jacobs, P., Richardson, M. & Rohde, R., 4 Jan 2017

    Article in Science Advances

  50. Atmospheric Chemistry of tert-butylamine and AMP

    Antonsen, S., Bunkan, A. J. C., D'Anna, B., Eichler, P., Farren, N., Hallquist, M., Hamilton, J. F., Kvarnliden, H., Mikoviny, T., Müller, M., Nielsen, C. J., Stenstrøm, Y., Tan, W., Wisthaler, A. & Zhu, L., 18 Aug 2017

    Article in Energy Procedia

  51. Automating tasks in protein structure determination with the Clipper Python module

    McNicholas, S., Croll, T., Burnley, T., Palmer, C. M., Hoh, S. W., Jenkins, H. T., Dodson, E., Cowtan, K. & Agirre, J., 13 Sep 2017

    Article in Protein science : a publication of the Protein Society

  52. Basin-Scale Observations of Monoterpenes in the Arctic and Atlantic Oceans

    Hackenberg, S., Andrews, S. J., Airs, R. L., Arnold, S. R., Bouman, H. A., Cummings, D., Lewis, A., Minaeian, J. K., Reifel, K. M., Small, A., Tarran, G. A., Tilstone, G. H. & Carpenter, L. J., 19 Sep 2017

    Article in Environmental science & technology

  53. Beta-Delayed fission of 230Am

    Wilson, G. L., Takeyama, M., Andreyev, A. N., Andel, B., Antalic, S., Catford, W. N., Ghys, L., Haba, H., Heßberger, F. P., Huang, M., Kaji, D., Kalaninova, Z., Morimoto, K., Morita, K., Murakami, M., Nishio, K., Orlandi, R., Smith, A. G., Tanaka, K., Wakabayashi, Y. & 1 othersYamaki, S., 13 Oct 2017

    Article in Physical Review C - Nuclear Physics

  54. Bio-based carbonaceous composite materials from epoxidised linseed oil, bio-derived curing agent and starch with controllable functionality

    Supanchaiyamat, N., Shuttleworth, P. S., Sikhom, C., Chaengkham, S., Yue, H. B., Fernández-Blázquez, J. P., Budarin, V. L. & Hunt, A. J., 4 May 2017

    Article in RSC Advances

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