2015 Publications

Beis K. (2015) "Structural basis for the mechanism of ABC transporters". Biochem Soc Trans, 43, 889-893

Gu R.X., Corradi V., Singh G., Choudhury H., Beis K., Tieleman DP. (2015) "Conformational Changes of the Antibacterial Peptide ABC Transporter McjD Revealed by Molecular Dynamics Simulations". Biochemistry, 54, 5989-5998

Axford D.H.N, Foadi, J., Choudhury H., Iwata, S, Beis K., Evans, G., Alguel, Y., (2015) "Structure determination of an integral membrane protein at room temperature from crystals in situ". Acta Crystallogr D Biol Crystallogr, D71, 1228-1237

Atwood, R.C., Bodey, A.J.,  Price, S.W.T.,  Basham, M.,  Drakopoulos M.,  (2015)  "A high-throughput system for high-quality tomographic reconstruction of large datasets at Diamond Light Source", Royal Society Philosophical Transactions A, 373: 20140398, DOI: 10.1098/rsta.2014.0398

Beale, A. M.,  Gao, F.,  Lezcano-Gonzalez, I.,  Peden, C.H.F.,  Szanyi, J.,  (2015)  "Recent advances in automotive catalysis for NOx emission control by small-pore microporous materials". Chemical Society Reviews, Advanced Publication - Reviews 44 (21), 7808-7828.

Bowker, M.,  House, M.,  Alshehri, A.,  Brookes, C.,  Gibson, E.K.,  Wells, P.P.   (2015)  "Selectivity determinants for dual function catalysts: applied to methanol selective oxidation on iron molybdate"  Catalysis Structure and Reactivity,  1(2):95-100. DOI:10.1179/2055075815Y.0000000002

Brookes, C.,  Bowker, M.,  Gibson, E.K.,  Diego Gianolio,   Khaled M. H. Mohammed,ace   Stephen Parry,d   Scott M. Rogers,ac   Ian P. Silverwoodac and    Peter P. Wells (2015) "In situ spectroscopic investigations of MoOx/Fe2O3 catalysts for the selective oxidation of methanol Catalysis" Science & Technology   DOI:10.1039/C5CY01175B

Brown, N.J.,  García-Trenco, A.,  Weiner, J., White, E.R.,  Allinson, Matthew., Chen Y.,  Wells, P.P., Gibson, E.K., Hellgardt, K., Shaffer M.S.P., and Williams, C.K.,  (2015) "From Organometallic Zinc and Copper Complexes to Highly Active Colloidal Catalysts for the Conversion of CO2 to Methanol"  ACS Catalysis, 5 (5):2895-2902. DOI:10.1021/cs502038y

Buffet, J-C,  Wanna, N.,  Arnold, T.A.Q., Gibson, E.K.,  Wells, P.P.,  Wang, Q.,  Tantirungrotechai, J.,  and O’Hare, D.,   (2015)  "Highly Tunable Catalyst Supports for Single-Site Ethylene Polymerization" Chemistry of Materials 02/2015; 27(5):150206033645009. DOI:10.1021/cm503433q

Gibson, E.K.,  Beale, A.M.,  Catlow, C.R.A.,  Chutia, A.,  Gianolio D.,  Gould, A.,  Kroner, A.,  Mohammed, K.M.H.,  Perdjon, M.,  Rogers, S.M.,  and Wells, P.P.  (2015)  "Restructuring of AuPd Nanoparticles Studied by a Combined XAFS/DRIFTS"  Approach Chemistry of Materials 27(10):150427095236004. DOI:10.1021/acs.chemmater.5b00866

Hinde, C.S.,   Ansovini, D.,  Wells, P.P.,  Collins, G.,  Van Aswegen, Si.,  Holmes, J.D.,  Andy Hor, T.S.,  and Raja, R.,  (2015) "Elucidating Structure-Property Relationships in the Design of Metal Nanoparticle Catalysts for the Activation of Molecular Oxygen" ACS Catal., 5 (6), pp 3807–3816. DOI:10.1021/acscatal.5b00481

Hinde, C.S.,  Gill, A.M.,  Wells,  P.P.,  Hor, A.T.S., and Raja R.,  (2015) "Utilizing Benign Oxidants for Selective Aerobic Oxidations Using Heterogenized Platinum Nanoparticle Catalysts" ChemPlusChem, 80(8). DOI:10.1002/cplu.201500195

Hoekstra, J.,  Beale, A. M.,  Soulimani, F.,  Versluijs-Helder, M.,  Geus, J. W.,  Jenneskens, L. W.,  (2015)  "Shell decoration of hydrothermally obtained colloidal carbon spheres with base metal nanoparticles". New Journal of Chemistry, 39 (8), 6593-6601;  

Hoekstra, J., Beale, A.M., Soulimani, F., Versluijs-Helder, M., Geus, J. W., Jenneskens, L.W.,  (2015)  "Base Metal Catalyzed Graphitization of Cellulose: A Combined Raman Spectroscopy, Temperature-Dependent X-ray Diffraction and High-Resolution Transmission Electron Microscopy Study". Journal of Physical Chemistry C , 119 (19), 10653-10661;

Iqbal, S.,  Kondrat, S.A., Jones, D.R.,  Schoenmakers, D.C.,  Edwards, J.K., Lu, Li.,  Yeo B.R., Wells, P.P., Gibson, E.K.,  Morgan, D.J.,  Kiely, C.J.  and Hutchings G.J.,   (2015)  "Ruthenium Nanoparticles Supported on Carbon: An Active Catalyst for the Hydrogenation of Lactic Acid to 1,2-Propanediol"  ACS Catal., 5, pp 5047–5059 DOI: 10.1021/acscatal.5b00625

Kennedy, J.,  Jones, W.,  Morgan, D.John.,  Bowker, M.,  Lu, L.,  Kiely, C.J.,  Wells, P.P., and Dimitratos, N.,  (2015)  "Photocatalytic hydrogen production by reforming of methanol using Au/TiO2, Ag/TiO2and Au-Ag/TiO2 catalysts"  Catalysis Structure and Reactivity, 1(1):35. DOI:10.1179/2055075814Y.0000000006

King, G.M.,  Iqbal, S.,  Miedziak, PJ.,  Brett, G.L.,  Kondrat, S.A.,  Yeo, B.R.,  Liu, X.,  Edwards, J.K., Morgan, D.J.,  Knight, D.K., Hutchings, G.J.  (2015) "An Investigation of the Effect of the Addition of Tin to 5 %Pd/TiO2 for the Hydrogenation of Furfuryl Alcohol" ChemCatChem, Volume 7, Issue 14 Pages 2122–2129  DOI:10.1002/cctc.201500242

Luo, W.,  Sankar, M., Beale, A.M.,  He, Q.,  Kiely, C.J.,  Bruijnincx, P.C.A.,  Weckhuysen, B.M.,  (2015)  "High performing and stable supported nano-alloys for the catalytic hydrogenation of levulinic acid to gamma-valerolactone",  Nature Communications 6; Article Number 6540;

Marin, R.P., Ishikawa, S., Bahruji, H., Shaw, G., Kondrat, S.A., Miedziak, P.J., Morgan, D.J, Taylor, S.H., Bartley, J.K., Edwards, J.K., Bowker, M., Ueda, W., and Hutchings, G.J., (2015)  "Supercritical antisolvent precipitation of TiO2 with tailored anatase/rutile composition for applications in redox catalysis and Ppotocatalysis". Applied Catalysis A: General 504, pp. 62-73. 10.1016/j.apcata.2015.02.023

Martin, D.J., Liu, G., Moniz, S.J.A., Bi, Y., Beale, A.M., Ye, J., Tang, J., (2015)  "Efficient visible driven photocatalyst, silver phosphate: performance, understanding and perspective". Chemical Society Reviews, Advanced Publication - on line only

Price, S.W.T.,  Geraki, K.,  Ignatyev, K.,  Witte, P.T.,  Beale, A.M.,  Mosselmans, J.F.W.,  (2015)  " In Situ Microfocus Chemical Computed Tomography of the Composition of a Single Catalyst Particle During Hydrogenation of Nitrobenzene in the Liquid Phase". Angewandte Chemie International Edition, 54 (34), 9886-9889.

Price, S.W.T.,  Ignatyev, K.,  Geraki, K.,  Basham, M.,  Filik, J.,  Vo, N.T.,  Witte, P.T.,  Beale, A.M.,  Mosselmans, J.F.W.,  (2015)  "Chemical imaging of single catalyst particles with scanning μ-XANES-CT and μ-XRF-CT"  Physical Chemistry Chemical Physics 17 (1), 521-529;

Rogers S.M.,  Catlow, C.R.A.,  Chan-Thaw, C.E.,  Gianolio, D.,  Gibson, E.K.,  Gould, A.L.,  Jian, Nan., Logsdail, A.J.,  Palmer, R.E.,  Prati, L.,  Dimitratos, N.,  Villa, A.,  and Wells P.P.  (2015)  "Tailoring Gold Nanoparticle Characteristics and the Impact on Aqueous-Phase Oxidation of Glycerol", ACS Catal., 5 (7), pp 4377–4384.

Vamvakeros, A., Jacques, S. D. M., Middelkoop, V., Di Michiel, M., Egan, C.K., Cernik, R. J. & Beale, A. M. (2015) "Removing multiple outliers and single crystal artefacts from X-ray diffraction computed tomography data".   Journal of Applied Crystallography, 48, 1943-1955;

Vamvakeros, A., Jacques, S.D.M., Middelkoop, V., Di Michiel, M., Egan, C.K., Ismagilov, I.Z., Vaughan, G.B.M., Gallucci, F., Annaland, M.V.S., Shearing, P.R., Cernik, R.J., Beale, A. M.,  (2015)  "Real time chemical imaging of a working catalytic membrane reactor during oxidative coupling of methane". Chemical Communications, 51 (64), 12752-12755;

Wang, J.,  Kondrat, S.A.,  Wang, Y.,  Brett, G.L.,  Giles, C.,  Bartley, J.K.,  Lu, L.,  Liu, Q.,  Kiely, C.J.,  and Hutchings G.J.,  (2015) "Au-Pd Nanoparticles Dispersed on Composite Titania/Graphene Oxide-Supports as a Highly Active Oxidation Catalyst" ACS Catal., 5 (6), pp 3575–3587   DOI:10.1021/acscatal.5b00480

Wells, P.P.,  Crabb, E.M.,  King, C.R.,  Fiddy, S.,  Amieiro-Fonseca, A., Thompsett, D.,  Russell A.E.  (2015) "Reduction properties of Ce in CeOx/Pt/Al2O3 catalysts". Catalysis Structure and Reactivity,  04 2915 OI:10.1179/2055075815Y.0000000001

Beale, A. M., Lezcano-Gonzalez, I., Maunula, T., Palgrave, R. G., (2015) “Development and characterization of thermally stable supported V–W–TiO2 catalysts for mobile NH3–SCR applications”. Catalysis, Structure and Reactivity 1 (1), 25-34;

Lezcano-Gonzalez, I., Wragg, D. S., Slawinski, W. A., Hemelsoet, K.,  Van Yperen-De Deyne, A., Waroquier, M., Van Speybroeck, V., Beale, A. M., (2015)  " Determination of the Nature of the Cu Coordination Complexes Formed in the Presence of NO and NH3 within SSZ-13". Journal of Physical Chemistry C, 119 (43), 24393-24403;

Baker, A. A., A. I. Figueroa, G. van der Laan, and T. Hesjedal, (2015), "Tailoring of magnetic properties of ultrathin epitaxial Fe films by Dy doping", AIP Adv. 5, 077117.

Baker, A.A., W. Braun, Gassler, G.,  Rembold, S.,  Fischer, A.,  and Hesjedal, T., (2015) "An ultra-compact, high-throughput molecular beam epitaxy growth system", Rev. Sci. Instrum. 86, 043901.

Baker, A.A., A. I. Figueroa, L. J. Collins-McIntyre, G. van der Laan, and T. Hesjedal, (2015), " Spin pumping in Ferromagnet-Topological Insulator-Ferromagnet Heterostructures", Scientific Reports 5, 7907.

Collins-McIntyre, L. J., W. Wang, B. Zhou, Y. L. Chen, T. Hesjedal, (2015), "Growth of Bi2Se3 and Bi2Te on Amorphous Fused Silica by MBE", Phys. Status Solidi B 252, 1334.

Figueroa, A. I., G. van der Laan, L. J. Collins-McIntyre, G. Cibin, A. J. Dent, and T. Hesjedal, (2015), "Local electronic and structural environment of transition metal doped Bi2Se3 topological insulator thin films", J. Phys. Chem. C 119, 17344

Figueroa, A. I., G. van der Laan, L. J. Collins-McIntyre, S.-L. Zhang, A.A. Baker, S.E. Harrison, P. Schönherr, G. Cibin, and T. Hesjedal, (2015), "Are the dopants in the Bi2Se3 topological insulator divalent or trivalent?", Diamond Light Source Annual Review 2014/15, p. 50f.

Harrison, S.E., Collins-McIntyre, L.J.,  Zhang, S.L.,  Baker, A.A.,  Figueroa, A.I.,  Kellock, A.J.,  Pushp, A., Parkin, S.S.P.,  Harris, J.S., Van der Laan, G.,  and Hesjedal, T., (2015) "Study of Dy-doped Bi2Te3 thin films: thin film growth and magnetic properties", J. Phys. – Cond. Mat. 27, 245602.

Lancaster, T., R.C. Williams, I.O. Thomas, F. Xiao, F.L. Pratt, S.J. Blundell, T. Hesjedal, M. Ciomaga Hatnean, and G. Balakrishnan, (2015)  "Transverse field muon-spin rotation signature of the skyrmion lattice phase in Cu2OSeO3", Phys. Rev. B 91, 224408

Schoenherr P. and Hesjedal, T. (2015) "Structural Properties and Growth Mechanism of Cd3As2 Nanowires", Appl. Phys. Lett. 106, 013115.

Schönherr, P.,  Zhang, S.L.,  Liu, Y.Q.,  Kusch, P.,  Reich, S.,  Giles, T.,  Daisenberger, D,.  Prabhakaran, D.,  Chen, Y.,  and Hesjedal, T,.  (2015)  "A New Topological Insulator Built From Quasi One-Dimensional Atomic Ribbons", Phys. Stat. Sol. RRL 9, 130.

Stenning, G. B. G., G. J. Bowden, P. A. J. de Groot, G. van der Laan, A. I. Figueroa, P. Bencok, P. Steadman, and T. Hesjedal, (2015), "Magnetic reversal in Dy-doped DyFe2/YFe2 superlattice films", Phys. Rev. B 91, 094403.

Stenning, G.B.G., L.R. Shelford, S.A. Cavill, F. Hoffmann, M. Haertinger, T. Hesjedal, G. Woltersdorf, G.J. Bowden, S.A. Gregory, L.C. Maple, C.H. Back, P.A.J. de Groot, and G. van der Laan, (2015), "Magnetization Dynamics in an Exchange-Coupled NiFe/CoFe Bilayer", New J. Phys. 17, 013019

Yang, G., D. L. Li, S. G. Wang, Q. L. Ma, S. H. Liang, H. X. Wei, X. F. Han, T. Hesjedal, R. C. C. Ward, A. Kohn, A. Elkayam, N. Tal, and X.-G. Zhang, (2015), "Effect of interfacial structures on spin dependent tunneling in fully epitaxial L10-FePt/MgO/FePt perpendicular magnetic tunnel junctions", J. Appl. Phys. 117, 083904.

Zhang, S.L., Baker, A.A., Zhang, J.Y., Yu, G.H., Wang, S.G., and Hesjedal, T., (2015), "Universal magnetic Hall circuit based on paired spin heterostructures", Adv. Elec. Mater. 1, 1400054.

Allen, C.S., Liberti, E., Kim, J.S., Xu, Q., Fan, Y., He, K., Robertson, A.W., Zandbergen, H.W., Warner, J.H., Kirkland, A. I.  (2015)  "Temperature dependence of atomic vibrations in mono-layer graphene" J. Appl. Phys., 118, 074302.

Boerrnert, F., Mueller, H., Riedel, T., Linck, M., Kirkland, A.I., Haider, M., Buechner, B., Lichte, H.. (2015)  "A flexible multi-stimuli in situ (S)TEM: Concept, optical performance, and outlook" Ultramicroscopy, 151, 31.

Borisenko, K.B., Shanmugam, J., Williams, B.A.O., Ewart, P., Gholipour, B., Hewak, D.W., Hussain, R., Jávorfi, T., Siligardi, G., Kirkland, A.I. (2015) "Photo-induced optical activity in phase-change memory materials". Sci. Rep., 5, 8770.  

Gong, C., Robertson, A.W., He, K., Lee, G.-D., Yoon, E., Allen, C.S., Kirkland, A.I., Warner, J.H.  (2015)  "Thermally Induced Dynamics of Dislocations in Graphene at Atomic Resolution" ACS Nano, 9, 10066-10075

He, K., Robertson, A.W., Fan, Y., Allen, C.S., Lin, Y.C., Suenaga, K., Kirkland, A.I., Warner, J.H.  (2015)  "Temperature Dependence of the Reconstruction of Zigzag Edges in Graphene" ACS Nano, 9, 4786.

He, K., Robertson, A.W., Gong, C., Allen, C.S., Xu, Q., Zandbergen, H., Grossman, J.C., Kirkland, A.I., Warner, J.H.  (2015)  "Controlled formation of closed-edge nanopores in graphene" Nanoscale, 7, 11602.

Kim, J.S.,  Warner, J.H.,  Robertson A.W., and Kirkland, A.I.  (2015)  "Formation of Klein Edge Doublets from Graphene Monolayers" ACS Nano, 9, 8916.

Robertson, A.W., Lee, G.D., He, K., Fan, Y., Allen, C.S., Lee, S., Kim, H., Yoon, E., Zheng, H., Kirkland, A.I., Warner, J.H.  (2015)  "Partial Dislocations in Graphene and Their Atomic Level Migration Dynamics" Nanoletters, 15, 5950.

Robertson, A.W., Lee, G.D., He, K., Gong, C., Chen, Q., Yoon, E., Kirkland, A.I., Warner, J.H.  (2015)  "Atomic Structure of Graphene Subnanometer Pores" ACS Nano, 9, 11599.

Clark, J.N., Beitra, L., Xiong, G., Fritz D.M., Lemke H.T., Zhu, D., Chollet, M., Williams, G.J., Messerschmidt., M.M., Abbey, B., Harder R.J., Korsunsky, A.M., Wark, J.S., Reis, D.A., Robinson, I.K., (2015)  "Imaging transient melting of a nanocrystal using an X-ray laser", Proceedings of the National Academy of Sciences, 112, 7444-7448

Gazzano, M., Gualandi, C., Zucchelli, A., Sui, T.,Korsunsky, A.M., Reinhard, C.,Focarete, M.L.,(2015) "Structure-morphology correlation in electrospun fibers of semicrystalline polymers by simultaneous synchrotron SAXS-WAXD", Polymer, 64, 154-163

Kirkwood H.J., Zhang S., Tremsin A.S., Korsunsky, A.M., Baimpas, N., Abbey, B., (2015) " Neutron Strain Tomography using the Radon Transform", Materials Today: Proceedings, 2, S414-S423

Korsunsky, A.M, Sui,T., Dluhoš, J., Ying, S., Lunt, A.J.G., Song B., Salvati E., Zhang H., Kim T., Kreynin, S.M. (2015) "Multi-Beam Engineering Microscopy-a Versatile Tool for Optimal Materials Design", Proceedings of the International MultiConference of Engineers and Computer Scientists, 2

Korsunsky, A.M., Sui, T., Song, B., (2015) "Explicit formulae for the internal stress in spherical particles of active material within lithium ion battery cathodes during charging and discharging", Materials & Design, 69, 247-252

Lunt A.J.G.,  Baimpas, N., Salvati, E.,  Dolbnya, I.P.,  Sui, T.,  Ying, S.,  Zhang, H.,  Kleppe, A.K., Dluhoš, J.,  (2015), "A state-of-the-art review of micron scale spatially resolved residual stress analysis by ring-core milling and other techniques", The Journal of Strain Analysis for Engineering Design, in press

Lunt, A.J.G., Kabra S., Kelleher J., Zhang S.Y., Neo, T.K., Korsunsky, A.M.(2015) "Tensile Secondary Creep Rate Analysis of a Dental Veneering Porcelain", Thin Solid Films, 596, 269–276

Lunt, A.J.G., Mohanty, G., Ying, S.,et al, Korsunsky, A.M., (2015), A Comparative Transmission Electron Microscopy, Electron Diffraction Spectroscopy and Spatially Resolved Micropillar Compression Study of the Yttria Partially Stabilised Zirconia – Porcelain Interface in Dental Prosthesis techniques, Thin Solid Film, in press

Lunt, A.J.G., Neo, T.K., Korsunsky, A.M., (2015), An Electron Microscopy Study of Sintering in Three Dental Porcelains, WCE proceeding, Volume II

Nguyen, G.D., Korsunsky, A.M., Belnoue, J.PH. (2015) "A nonlocal coupled damage-plasticity model for the analysis of ductile failure", International Journal of Plasticity,64, 56-75

Petit, J., Castelnau, O., Bornert, M., Zhang, F.G., Hofmann F., Korsunsky, A.M., Faurie, D., Bourlot C.L., Micha, J.S., Robach, O., Ulrich, O., (2015) "Laue-DIC: a new method for improved stress field measurements at the micrometer scale", Synchrotron Radiation, 22, 4

Salvati E., O’Connor S., Nowell D., Korsunsky A.M., (2015) "EBSD Investigation of Fatigue Crack Propagation Past a Crack Closure Due to Overload". 5th International Crack Paths proceeding.DOI: 10.3221/IGF-ESIS.tt.uu

Salvati, E., Benedetti, M., Sui, T., Korsunsky, A.M., (2015) "Residual Stress Measurement on Shot Peened Samples Using FIB-DIC", SCM proceedin, DOI:10.14130/RG.2.1.4333.6800

Salvati, E., Lunt, A.J.G., Sui, T., Korsunsky, A.M. (2015) "An Investigation of Residual Stress Gradient Effects in FIB-DIC Micro-Ring-Core Analysis", Proceedings of the International MultiConference of Engineers and Computer Scientists, Volume II

Song, X., Xie, M., Hofmann, F., Illston, T., Connolley, T., Reinhard, C., Atwood, R.C.,, Connor, L., Drakopoulos, M., Frampton, L., Korsunsky, A.M. (2015) "Residual stresses and microstructure in Powder Bed Direct Laser Deposition (PB DLD) samples", International Journal of Material Forming, 8, 245-254

Sui, T., Baimpas, N., Dolbnya, I.P., Prisacariu, C., Korsunsky,A.M., (2015) "Multiple-length-scale deformation analysis in a thermoplastic polyurethane", Nature Communications, 6, Article number: 6583

Sui, T., Ying, S, Landini, G., Korsunsky,A.M., (2015) "X-ray Study of Human Dental Tissues Affected by Erythroblastosis" Fetalis", Journal of Dental Research, 94(7) 1004-1010

Sui, T., Ying, S., Baimpas N., Landini G., Korsunsky, A.M., (2005) "In situ X-ray diffraction measurements of the apparent modulus of human dental tissue in the vicinity of the dentine-enamel junction" (DEJ), ICMAE proceeding, Applied Mechanics & Materials;798, 339

Sui, T., Zhang, H., Ying, S., O'Brien, P., Korsunsky, A.M. (2015) "FIB-SEM Serial Sectioning Nanotomography of Flax Fibres", Proceedings of the International MultiConference of Engineers and Computer Scientists, 2

Zhang, H., Sui,T., Thygesen, L.G., Brien P., Korsunsky, A.M., (2015) "Multi-modal Microscopy Characterisation of Nodal Markings in Flax Fibre", WCE proceeding ,  Vol II

Zhang, S., Compagnon, E., Godin, B., Korsunsky, A.M., (2015) "Investigation of Martensite Transformation in 316L Stainless Steel", Materials Today: Proceedings, 2, S251-S260

Dupré, E., Herrou, J., Lensink, M. F., Wintjens, R., Vagin, A., Lebedev, A., croon, S., Villeret, V., Locht, C., Antoine, R. and Jacob-Dubuisson, F. (2015) "Virulence Regulation with Venus Flytrap Domains: Structure and Function of the Periplasmic Moiety of the Sensor-Kinase BvgS" PLoS pathogens, 11 (3), e1004700-e1004700.

Krissinel, E. (2015) “CCP4 Software Suite: historia, evolución, contenido, retos y perspectivas de futuro", Arbor, 191(772):a220, doi:10.3989/arbor.2015.772n2006.

Krissinel, E. (2015) “Stock-based detection of protein oligomeric states in jsPISA", Nucleic Acids Res., doi: 10.1093/nar/gkv314.

Ostrowski, A., Gundogdu, M., Ferenbach, A. T., Lebedev, A. A. and van Aalten, D. M. (2015)  "Evidence for a Functional O-Linked N-Acetylglucosamine (O-GlcNAc) System in the Thermophilic Bacterium Thermobaculum terrenum"  J Biol. Chem., 290 (51), 30291-30305.

Thomas, J.M.H., Keegan, R.M., Bibby, J., Winn, M.D., Mayans, O. and Rigden, D.J. (2015) “Routine phasing of coiled-coil protein crystal structures with AMPLE", IUCRJ, 2, 198-206.

Adamczyk, K., Simpson, N., Greetham, G. M., Gumiero, A., Walsh, M. A., Towrie, M., Parker, A. W. & Hunt, N. T. (2015). “Ultrafast infrared spectroscopy reveals water-mediated coherent dynamics in an enzyme active site.” Chemical Science, 6:1, 505-16.

Arrowsmith, R. L., Atkin, A. J., Botchway, S. W., Fairlamb, I. J. S., Lynam, J. M., Moir, J. W. B., Pascu, S. I., Ward, J. S. & Zhang, W.-Q. (2015). “Confocal and fluorescence lifetime imaging sheds light on the fate of a pyrene-tagged carbon monoxide-releasing Fischer carbene chromium complex.” Dalton Transactions, 44:11, 4957-62.

Beeby, A., Duckworth, A.R., Gameson, R.G.,  Nicholson, C.E.,  Clark, R.,  Meehan, B.,  Parker A.W.,  (2015) "Pigments of the Earliest Northumbrian Manuscripts"  SCRIPTORIUM Tome LXIX, 33-51

Bolognesi, G., Hargreaves, A., Ward, A. D., Kirby, A. K., Bain, C. D. & Ces, O. (2015). “Microfluidic generation of monodisperse ultra-low interfacial tension oil droplets in water.” RSC Advances, 5:11, 8114-21.

Bolognesi, G., Hargreaves, A., Ward, A. D., Kirby, A. K., Neil, M., Bain, C. D. & Ces, O. (2015). “Microfluidic generation and optical manipulation of ultra-low interfacial tension droplets.” In J. M. Fedeli (Ed.) Integrated Photonics: Materials, Devices, and Applications III.

Botchway, S.W., Coulter, J.A. & Currell, F.J. (2015). “Imaging intracellular and systemic in vivo gold nanoparticles to enhance radiotherapy.” British Journal of Radiology, 88, 1054.

Botchway, S. W., Scherer, K. M., Hook, S., Stubbs, C. D., Weston, E., Bisby, R. H. & Parker, A. W. (2015). “A series of flexible design adaptations to the Nikon E-C1 and E-C2 confocal microscope systems for UV, multiphoton and FLIM imaging.” Journal of Microscopy, 258:1, 68-78.

Buckley, K., Kerns, J. G., Vinton, J., Gikas, P. D., Smith, C., Parker, A. W., Matousek, P. & Goodship, A. E. (2015). “Towards the in vivo prediction of fragility fractures with Raman spectroscopy.” Journal of Raman Spectroscopy, 46:7, 610-18.

Coban, O., Zanetti-Dominguez, L. C., Matthews, D. R., Rolfe, D. J., Weitsman, G., Barber, P. R., Barbeau, J., Devauges, V., Kampmeier, F., Winn, M., Vojnovic, B., Parker, P. J., Lidke, K. A., Lidke, D. S., Ameer-Beg, S. M., Martin-Fernandez, M. L. & Ng, T. (2015). “Effect of Phosphorylation on EGFR Dimer Stability Probed by Single-Molecule Dynamics and FRET/FLIM.” Biophysical Journal, 108:5, 1013-26

Conti, C., Colombo, C., Realini, M. & Matousek, P. (2015). “Subsurface analysis of painted sculptures and plasters using micrometre-scale spatially offset Raman spectroscopy (micro-SORS).” Journal of Raman Spectroscopy, 46:5, 476-82

Conti, C., Realini, M., Colombo, C. & Matousek, P. (2015). “Comparison of key modalities of micro-scale spatially offset Raman spectroscopy.” Analyst, 140:24, 8127-33.

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Fedoseeva, M., Delor, M., Parker, S. C., Sazanovich, I. V., Towrie, M., Parker, A. W. & Weinstein, J. A. (2015). “Vibrational energy transfer dynamics in ruthenium polypyridine transition metal complexes.” Physical Chemistry Chemical Physics, 17:3, 1688-96.

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Heyes, D. J., Hardman, S. J. O., Hedison, T. M., Hoeven, R., Greetham, G. M., Towrie, M. & Scrutton, N. S. (2015). “Excited-State Charge Separation in the Photochemical Mechanism of the Light-Driven Enzyme Protochlorophyllide Oxidoreductase.” Angewandte Chemie-International Edition, 54:5, 1512-15.

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Kerns, J.G., Buckley, K., Parker, A.W., Birch, H.L., Matousek, P., Hildred, A. & Goodship, A.E. (2015). “The use of laser spectroscopy to investigate bone disease in King Henry VIII”s sailors.” Journal of Archaeological Science, 53, 516-20.

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Huang X., Yang W., Harder, R., Sun, Y,. Lu, M,. Chu, Y.S., Robinson, I.K., Mao H.K.,  (2015"  "Deformation twinning of a silver nanocrystal under high pressure",   ACS Nano Lett. (15):7644-9.

J. N. Clark, L. Beitra, G. Xiong, D. M. Fritz, H. T. Lemke, D. Zhu, M. Chollet, G. J. Williams, M. Messerschmidt, B. Abbey, R. J. Harder, A. M. Korsunsky, J. S. Wark, D. Reis and I. K. Robinson (2015) “Imaging transient melting of a nanocrystal using an x-ray laser”, Proceedings of the National Academy of Sciences, http://dx.doi.org /10.1073/pnas.1417678112"

Liu, X.,  Aranda, M., Chen, Bo.,  Wang, P.,  Harder, Ross.,  and Robinson, Ian.,  (2015)  “In Situ Bragg Coherent Diffraction Imaging Study of a Cement Phase Microcrystal during Hydration”,  Crystal Growth and Design  http://dx.doi.org /10.1021/cg5013389

Miao, Ji.,  Ishikawa, T.,  Robinson I.K.,  and Murnane, M.M., (2015)  “Beyond Crystallography: Diffractive Imaging Using Coherent X-ray Light Sources”  Science 348 530-535  DOI:10.1126/science.aaa1394

Robinson, I.,  and Robinson, S., (2015) "My Life and the World of Crystals" Physica Scripta 90 048003 - doi:10.1088/0031-8949/90/4/048003

Shemilt, L.,  Schwenke, J.,  Verbanis, E.,  Zhang, F.,  Yusuf, M.,  Estandarte, A.K.,  Xiong, G.,  Harder, R.,  and Robinson, I.K.  (2015)  “Karyotyping human chromosomes by optical and X-ray ptychography methods”, Biophysical Journal 108 706–713  -  http://dx.doi.org/10.1016/j.bpj.2014.11.3456

Ulvestad, A.,  Clark, J.N., Harder R., Shpyrko O.G.,  and Robinson, I.K.  (2015) “3D Imaging of Twin Domain Defects in Gold Nanoparticles”,  Nano Lett. Jun 10;15(6):4066-70.

Vittoria, F.A.,  Endrizzi, M.,  Diemoz, P.C.,  Zamir, A.,  Wagner, U.H.,  Rau, C.,  Robinson, I.K.,  and Olivo, A.,  (2015) "X-ray absorption, phase and dark-field tomography through a beam tracking approach",  Nature Scientific Reports 5 16318

Vittoria, F.A.,  Kallon, G.K.N.,  Basta, D.,  Diemoz, P.C., Robinson, I.K.  Olivo, A.,  and Endrizzi, M., (2015) “Beam tracking approach for single-shot retrieval of absorption, refraction and dark-field signals with laboratory x-ray sources”, accepted in Applied Physics Letters

"Arena de Souza, A., Scott, D.J., Nettleship, J.E., Rahman, N., Charlton, M.H., Walsh, M.A. & Owens, R.J. (2015) ""Comparison of the Structure and Activity of Glycosylated and Aglycosylated Human Carboxylesterase"" 1PLoS One Dec 11 10 (12):e0143919 "

Wills, P.R., Scott, D.J. & Winzor, D.J. (2015). "The osmotic second virial coefficient for protein self-interaction: use and misuse to describe thermodynamic nonideality". Analytical Biochemistry 490 55-65

Scott, D.J., Harding, S.E. & Winzor, D.J. (2015). "Evaluation of diffusion coefficients by means of an approximate steady-state condition in sedimentation velocity distributions"  Analytical Biochemistry 490 20-25

"Scott, D.J. and Winzor, D.J. (2015). ""Characterization of Intrinsically Disordered Proteins by Analytical Ultracentrifugation"". Methods in Enzymology 562 225-239."

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Aller P., Sanchez-Weatherby J., Foadi J., Winter G., Lobley C.M., Axford D., Ashton A.W., Bellini D., Brandao-Neto J., Culurgioni S., Douangamath A., Duman R., Evans G., Fisher S., Flaig R., Hall D.R., Lukacik P., Mazzorana M., McAuley K.E., Mykhaylyk V., Owen R.L., Paterson N.G., Romano P., Sandy J., Sorensen T., von Delft F., Wagner A., Warren A., Williams M., Stuart D.I., Walsh M.A., (2015) “Application of in situ diffraction in high-throughput structure determination platforms”. Methods Mol Biol. 1261, 233-53;

Arena de Souza V., Scott D.J., Nettleship JE, Rahman N., Charlton M.H., Walsh M.A., Owens R.J., (2015) “Comparison of the Structure and Activity of Glycosylated and Aglycosylated Human Carboxylesterase 1”. PLoS One, 10(12),e0143919;

Lukacik P., Lobley C.M., Bumann M., Arena de Souza V., Owens R.J., O'Toole P.W., Walsh M.A., (2015) “High-resolution structures of Lactobacillus salivarius transketolase in the presence and absence of thiamine pyrophosphate”.Acta Crystallogr F Struct Biol Commun. 71(10),1327-34;

Owen C.D., Lukacik P., Potter J.A., Sleator O., Taylor G.L., Walsh M.A., (2015) “Streptococcus pneumoniae NanC: STRUCTURAL INSIGHTS INTO THE SPECIFICITY AND MECHANISM OF A SIALIDASE THAT PRODUCES A SIALIDASE INHIBITOR”. J Biol Chem., 290(46), 27736-48;

Cheng, A., Henderson, R., Mastronarde, D., Ludtke, S.J., Schoenmakers, R.H., Short, J., Marabini, R., Dallakyan, S., Agard, D. and Winn, M.D. (2015) “MRC2014: Extensions to the MRC format header for electron cryo-microscopy and tomography”, J. Struct. Biol. in press

Coban, O.C., Winn, M.D., Martin-Fernandez, M.L., Zanetti-Dominguez, L.C.,  Matthews, D.,  Rolfe, D.,  Weitsman, G.,  Barber, P., Barbeau, J., Devauges, V.,  Kampmeier, F.,  Vojnovic, B.,  Parker, P., Lidke, K.,  D Lidke, Ameer-Beg, S., Ng, T ., (2015) "Effect of phosphorylation on the EGFR dimer stability probed by single-molecule dynamics and FRET/FLIM", Biophys. J., 108, 1013–1026

E. Krissinel (2015) “Stock-based detection of protein oligomeric states in jsPISA”, Nucl. Acids. Res. 43, W314-W319

Farabella, I.,  Vasishtan, D., Joseph, A. P., Pandurangan, A.P.,  Sahota, H. and Topf M. (2015) “TEMPy: a Python library for assessment of three-dimensional electron microscopy density fits”, J. Appl. Cryst. 48, 1314–1323

Keegan, R.M., Bibby, J., Thomas, J., Xu, D., Zhang, Y., Mayans, O., Winn, M.D. and Ridgen, D.J. (2015) “Exploring the speed and performance of molecular replacement with AMPLE using QUARK ab initio protein models” Acta Cryst., D71, 338 – 343

Kiuchi, T., Winn, M.D., Martin-Fernandez, M.L. et al., (2014) “The ErbB4 CYT2 variant protects EGFR from ligand-induced degradation to enhance cancer cell motility” Sci. Signal., 7, ra78

Wood, C., Burnley, T., Patwardhan, A., Scheres, S., Topf, M., Roseman, A. and Winn, M.D. (2015) “Collaborative Computational Project for Electron cryo-Microscopy” Acta Cryst., D71, 123 – 126

Azeem, M. A. and Dye, D. (2015). "Lattice instability during the martensitic transformation in the high temperature shape memory alloy Zr(Cu0.5Co0.25Ni0.25)" Journal of Alloys and Compounds 618 (0), 469-474 DOI: http://dx.doi.org/10.1016/j.jallcom.2014.08.141

Cai, B., Karagadde, S., Marrow, T. J., Connolley, T. and Lee, P. D. (2015). "Synchrotron X-ray Tomographic Quantification of Deformation Induced Strain Localisation in Semi-solid Al- 15wt.%Cu" IOP Conference Series: Materials Science and Engineering 84 (1), 012079 DOI: http://dx.doi.org/10.1088/1757-899X/84/1/012079  

Cai, B., Karagadde, S., Rowley, D., Marrow, D.T., Connolley, T. and Lee, P.D. (2015). "Quantifying deformation-induced liquid flow in an equiaxed dendritic Al-Cu alloy with time resolved synchrotron tomography" Scripta Materialia DOI: 10.1016/j.scriptamat.2015.03.011, DLS/I12

Cai, B., Karagadde, S., Rowley, D., Marrow, T. J., Connolley, T. and Lee, P. D. (2015). "Time-resolved synchrotron tomographic quantification of deformation-induced flow in a semi-solid equiaxed dendritic Al–Cu alloy" Scripta Materialia 103 (0), 69-72 DOI: http://dx.doi.org/10.1016/j.scriptamat.2015.03.011  

Cai, B., Zheng, Z. Q., He, D. Q., Li, S. C. and Li, H. P. (2015). "Friction stir weld of 2060 Al–Cu–Li alloy: Microstructure and mechanical properties" Journal of Alloys and Compounds 649, 19-27 DOI: http://dx.doi.org/10.1016/j.jallcom.2015.02.124

Carr, J., Milhet, X., Gadaud, P., Boyer, S. A. E., Thompson, G. E. and Lee, P. (2015). "Quantitative characterization of porosity and determination of elastic modulus for sintered micro-silver joints" Journal of Materials Processing Technology 225, 19-23 DOI: http://dx.doi.org/10.1016/j.jmatprotec.2015.03.037

Chapman, T. P., Kareh, K. M., Knop, M., Connolley, T., Lee, P. D., Azeem, M. A., Rugg, D., Lindley, T. C. and Dye, D. (2015). "Characterisation of short fatigue cracks in titanium alloy IMI 834 using X-ray microtomography" Acta Materialia 99, 49-62 DOI: http://dx.doi.org/10.1016/j.actamat.2015.07.069

Egan, C. K., Jacques, S. D. M., Wilson, M. D., Veale, M. C., Seller, P., Beale, A. M., Pattrick, R. A. D., Withers, P. J. and Cernik, R. J. (2015). "3D chemical imaging in the laboratory by hyperspectral X-ray computed tomography" Scientific Reports 5 DOI: http://dx.doi.org/10.1038/srep15979

Egan, C. K., Jacques, S. D., Wilson, M. D., Veale, M. C., Seller, P., Withers, P. J. and Cernik, R. J. (2015). "Full-field energy-dispersive powder diffraction imaging using laboratory X-rays" Journal of Applied Crystallography 48 (1), 269-272 DOI: http://dx.doi.org/10.1107/S1600576715000801

Finegan, D. P., Tudisco, E., Scheel, M., Robinson, J. B., Taiwo, O. O., Eastwood, D. S., Lee, P. D., Di Michiel, M., Bay, B., Hall, S. A., Hinds, G., Brett, D. J. L. and Shearing, P. R. (2015). "Quantifying Bulk Electrode Strain and Material Displacement within Lithium Batteries via High-Speed Operando Tomography and Digital Volume Correlation" Advanced Science, 1500332 DOI: http://dx.doi.org/10.1002/advs.201500332

Hernández-Nava, E., Smith, C., Derguti, F., Tammas-Williams, S., Léonard, F., Withers, P., Todd, I. and Goodall, R. (2015). "The effect of density and feature size on mechanical properties of isostructural metallic foams produced by additive manufacturing" Acta Materialia 85, 387-395 DOI: http://dx.doi.org/10.1016/j.actamat.2014.10.058

Karagadde, S., Lee, P. D., Cai, B., Fife, J. L., Azeem, M. A., Kareh, K. M., Puncreobutr, C., Tsivoulas, D., Connolley, T. and Atwood, R. C. (2015). "Transgranular liquation cracking of grains in the semi-solid state" Nature Commun 6 DOI: http://dx.doi.org/10.1038/ncomms9300

Kazantsev, D., Thompson, W. M., Lionheart, W. R. B., Eyndhoven, G. E., Kaestner, A. P., Dobson, K. J., Withers, P. J. and Lee, P. D. (2015). "4D-CT reconstruction with unified spatial-temporal patch-based regularization" Inverse Problems and Imaging Journal 9 (2), 447-467 DOI: http://dx.doi.org/10.3934/ipi.2015.9.447

Kazantsev, D., Van Eyndhoven, G., Lionheart, W. R. B., Withers, P. J., Dobson, K. J., McDonald, S. A., Atwood, R. and Lee, P. D. (2015). "Employing temporal self-similarity across the entire time domain in computed tomography reconstruction" Philosophical Transactions of the Royal Society of London A: Mathematical, Physical and Engineering Sciences 373 (2043) DOI: http://dx.doi.org/10.1098/rsta.2014.0389

Lin, Q., Neethling, S. J., Dobson, K. J., Courtois, L. and Lee, P. D. (2015). "Quantifying and minimising systematic and random errors in X-ray micro-tomography based volume measurements" Computers & Geosciences 77 (0), 1-7 DOI: http://dx.doi.org/10.1016/j.cageo.2014.12.008

Lowe, T., Bradley, R., Yue, S., Barii, K., Gelb, J., Rohbeck, N., Turner, J. and Withers, P. (2015). "Microstructural analysis of TRISO particles using multi-scale X-ray computed tomography" Journal of Nuclear Materials 461, 29-36 DOI: http://dx.doi.org/10.1016/j.jnucmat.2015.02.034

Mills, K. C., Karagadde, S., Yuan, L., Shahbazian, S. and Lee, P. D. (2015). "Calculation Of Physical Properties For Use In Models Of The Continuous Casting Process: Part 1 –Mould Slags" ISIJ International  DOI: http://dx.doi.org/10.2355/isijinternational.ISIJINT-2015-364

Mills, K. C., Karagadde, S., Yuan, L., Shahbazian, S. and Lee, P. D. (2015). "Calculation Of Physical Properties For Use In Models Of The Continuous Casting Process: Part 2 -Steels" ISIJ International  DOI: http://dx.doi.org/10.2355/isijinternational.ISIJINT-2015-365

Mostafavi, M., Collins, D. M., Cai, B., Bradley, R., Atwood, R. C., Reinhard, C., Jiang, X., Galano, M., Lee, P. D. and Marrow, T. J. (2015). "Yield behavior beneath hardness indentations in ductile metals, measured by three-dimensional computed X-ray tomography and digital volume correlation" Acta Materialia 82 (0), 468-482 DOI: http://dx.doi.org/10.1016/j.actamat.2014.08.046

Qiu, C., Yue, S., Adkins, N. J. E., Ward, M., Hassanin, H., Lee, P. D., Withers, P. J. and Attallah, M. M. (2015). "Influence of processing conditions on strut structure and compressive properties of cellular lattice structures fabricated by selective laser melting" Materials Science and Engineering: A 628 (0), 188-197 DOI: http://dx.doi.org/10.1016/j.msea.2015.01.031

Robinson, J. B., Brown, L. D., Jervis, R., Taiwo, O. O., Heenan, T. M. M., Millichamp, J., Mason, T. J., Neville, T. P., Clague, R., Eastwood, D. S., Reinhard, C., Lee, P. D., Brett, D. J. L. and Shearing, P. R. (2015). "Investigating the effect of thermal gradients on stress in solid oxide fuel cell anodes using combined synchrotron radiation and thermal imaging" Journal of Power Sources 288 (0), 473-481 DOI: http://dx.doi.org/10.1016/j.jpowsour.2015.04.104  

Rockett, P., Karagadde, S., Guo, E., Bent, J., Hazekamp, J., Kingsley, M., Vila-Comamala, J. and Lee, P. D. (2015). "A 4-D dataset for validation of crystal growth in a complex three-phase material, ice cream" IOP Conference Series: Materials Science and Engineering 84 (1), 012076 DOI: http://dx.doi.org/10.1088/1757-899X/84/1/012076  

Schurch, R., Rowland, S. M., Bradley, R. S. and Withers, P. J. (2015). "Comparison and Combination of Imaging Techniques for Three Dimensional Analysis of Electrical Trees" IEEE Transactions on Dielectrics and Electrical Insulation 22 (2), 709-719 DOI: http://dx.doi.org/10.1109/tdei.2014.004730

Sercombe, T. B., Xu, X., Challis, V. J., Green, R., Yue, S., Zhang, Z. and Lee, P. D. (2015). "Failure modes in high strength and stiffness to weight scaffolds produced by Selective Laser Melting" Materials & Design 67 (0), 501-508 DOI: http://dx.doi.org/10.1016/j.matdes.2014.10.063

Simpson, C., Withers, P., Lowe, T., Roy, S. and Wanner, A. (2015). "Damage evolution in freeze cast metal/ceramic composites exhibiting lamellar microstructures" Fracture and Structural Integrity(33), 134-142 DOI: http://dx.doi.org/10.3221/IGF-ESIS.33.17

Tzanakis, I., Xu, W. W., Eskin, D. G., Lee, P. D. and Kotsovinos, N. (2015). "In situ observation and analysis of ultrasonic capillary effect in molten aluminium" Ultrasonics Sonochemistry 27, 72-80 DOI: http://dx.doi.org/10.1016/j.ultsonch.2015.04.029

Van Eyndhoven, G., Batenburg, K. J., Kazantsev, D., Van Nieuwenhove, V., Lee, P. D., Dobson, K. J. and Sijbers, J. (2015). "An Iterative CT Reconstruction Algorithm for Fast Fluid Flow Imaging" Image Processing, IEEE Transactions on 24 (11), 4446-4458 DOI: http://dx.doi.org/10.1109/tip.2015.2466113  

Wang, D., Romer, F., Connell, L. S., Walter, C., Saiz, P. E., Yue, S., Lee, P. D., McPhail, D., Hanna, J. V. and Jones, J. R. (2015). "Highly flexible silica/chitosan hybrid scaffolds with oriented pores for tissue regeneration" Journal of Materials Chemistry B  DOI: http://dx.doi.org/10.1039/c5tb00767d

Withers, P. J. (2015). "Fracture mechanics by three-dimensional crack-tip synchrotron X-ray microscopy" Philosophical Transactions of the Royal Society of London A: Mathematical, Physical and Engineering Sciences 373 (2036), 20130157 DOI: http://dx.doi.org/10.1098/rsta.2013.0157

Xu, W., Horsfield, A. P., Wearing, D. and Lee, P. D. (2015). "First-principles calculation of Mg/MgO interfacial free energies" Journal of Alloys and Compounds 650, 228-238 DOI: http://dx.doi.org/10.1016/j.jallcom.2015.07.289