Items where subject is "Physical and theoretical chemistry"

2024

Buerkle, Marius and Padmanaban, Dilli babu and McGlynn, Ruairi and Mariotti, Davide and Svrcek, Vladimir (2024) Unexpected electronic features of NiO quantum dots produced by femtosecond pulsed laser ablation in water. Journal of Physical Chemistry Letters, 15 (15). pp. 4185-4190. ISSN 1948-7185

Doveiko, Daniel and Kubiak-Ossowska, Karina and Chen, Yu (2024) Estimating binding energies of π-stacked aromatic dimers using force field-driven molecular dynamics. International Journal of Molecular Sciences, 25 (11). 5783. ISSN 1422-0067

Haq, Atta ul and Buerkle, Marius and Alessi, Bruno and Svrcek, Vladimir and Maguire, Paul and Mariotti, Davide (2024) Cluster-doping in silicon nanocrystals. Nanoscale Horizons, 9 (11). pp. 2042-2050. ISSN 2055-6764

Jaconelli, Harry S. and Kennedy, Alan R. (2024) Salt forms of amides : protonation of acetanilide. Acta Crystallographica Section C: Structural Chemistry, 80 (Pt. 9). pp. 514-522. C80. ISSN 2053-2296

Lue, Leo and Pruteanu, Ciprian G. and Ackland, Graeme J. (2024) The re-entrant transition from the molecular to atomic phases of dense fluids : the case of hydrogen. Journal of Chemical Physics, 160 (19). 194502. ISSN 0021-9606

McCready, Connaire and Sladekova, Kristina and Conroy, Stuart and Gomes, José R. B. and Fletcher, Ashleigh J. and Jorge, Miguel (2024) Quantifying the uncertainty of force field selection on adsorption predictions in MOFs. Journal of Chemical Theory and Computation, 20 (11). pp. 4869-4884. ISSN 1549-9618

McFarlan, Catriona and Parrott, Andrew and Dunn, Jaclyn and Speed, Jonathon and Wood, Dan and Nordon, Alison (2024) Use of a rugged mid-infrared spectrometer for in situ process analysis of liquids. Vibrational Spectroscopy, 135. 103747. ISSN 0924-2031

Osipov, M.A. (2024) Dipole-dipole interactions and the origin of ferroelectric ordering in polar nematics. Liquid Crystals. pp. 1-7. ISSN 0267-8292

Urquhart, Ross James and van Teijlingen, Alexander and Tuttle, Tell (2024) ANI neural network potentials for small molecule pKa prediction. Physical Chemistry Chemical Physics, 26 (36). pp. 23934-23943. ISSN 1463-9084

2023

Aatkar, Arron and Vuorinen, Aini and Longfield, Oliver E. and Gilbert, Katharine and Peltier-Heap, Rachel and Wagner, Craig D. and Zappacosta, Francesca and Rittinger, Katrin and Chung, Chun-wa and House, David and Tomkinson, Nicholas C. O. and Bush, Jacob T. (2023) Efficient ligand discovery using sulfur(VI) fluoride reactive fragments. ACS Chemical Biology, 18 (9). pp. 1926-1937. ISSN 1554-8937

Barrera, Maria Cecilia and Cree, Jordan and Gomes, José R. B. and Jorge, Miguel (2023) Polarization-consistent force field for ketones. Journal of Molecular Liquids, 383. 122070. ISSN 0167-7322

Bruns, Nico and Nardin, Corinne and Palivan, Cornelia G. (2023) Obituary : Prof. Dr. Wolfgang Peter Meier (1964–2022). Macromolecular Rapid Communications, 44 (16). 2300401. ISSN 1022-1336

Bruns, Nico and Nardin, Corinne and Palivan, Cornelia G. (2023) Obituary : Prof. Dr. Wolfgang Peter Meier (1964–2022). Macromolecular Bioscience, 23 (8). 2300309. ISSN 1616-5187

Chattopadhyay, Purnesh and Ariza-Tarazona, Maria Camila and Cedillo-González, Erika Iveth and Siligardi, Cristina and Simmchen, Juliane (2023) Combining photocatalytic collection and degradation of microplastics using self-asymmetric Pac-Man TiO2. Nanoscale, 15 (36). pp. 14774-14781. ISSN 2040-3372

Chong, Magdalene W. S. and Parrott, Andrew J. and Ashworth, David J. and Fletcher, Ashleigh J. and Nordon, Alison (2023) Non-invasive monitoring of the growth of metal–organic frameworks (MOFs) via Raman spectroscopy. Physical Chemistry Chemical Physics, 25 (21). pp. 14869-14878. ISSN 1463-9084

Cordina, Robert J. and Smith, Beccy and Tuttle, Tell (2023) COGITO : a coarse-grained force field for the simulation of macroscopic properties of triacylglycerides. Journal of Chemical Theory and Computation, 19 (4). pp. 1333-1341. ISSN 1549-9618

Dayarian, Shima and Far, Hojat Majedi and Yang, Liu (2023) Macroporous polyimide aerogels : a comparison between powder microparticles synthesized via wet gel grinding and emulsion processes. Langmuir, 39 (5). pp. 1804-1814. ISSN 0743-7463

Fowles, Daniel J. and Palmer, David S. (2023) Solvation entropy, enthalpy and free energy prediction using a multi-task deep learning functional in 1D-RISM. Physical Chemistry Chemical Physics, 25 (9). pp. 6944-6954. ISSN 1463-9084

Gilbert, Katharine E. and Vuorinen, Aini and Aatkar, Arron and Pogány, Peter and Pettinger, Jonathan and Grant, Emma K. and Kirkpatrick, Joanna M. and Rittinger, Katrin and House, David and Burley, Glenn A. and Bush, Jacob T. (2023) Profiling sulfur(VI) fluorides as reactive functionalities for chemical biology tools and expansion of the ligandable proteome. ACS Chemical Biology, 18 (2). pp. 285-295. ISSN 1554-8937

Herdly, Lucas and Tinning, Peter W. and Geiser, Angéline and Taylor, Holly and Gould, Gwyn W. and van de Linde, Sebastian (2023) Benchmarking thiolate driven photoswitching of cyanine dyes. Journal of Physical Chemistry B, 127 (3). pp. 732-741. ISSN 1520-6106

Jorge, Miguel and Barrera, Maria Cecilia and Milne, Andrew W. and Ringrose, Chris and Cole, Daniel J. (2023) What is the optimal dipole moment for non-polarizable models of liquids? Journal of Chemical Theory and Computation, 19 (6). pp. 1790-1804. ISSN 1549-9618

Koshti, Bharti and Swanson, Hamish W. A. and Wilson, Basil and Kshtriya, Vivek and Naskar, Soumick and Narode, Hanuman and Lau, King Hang Aaron and Tuttle, Tell and Gour, Nidhi (2023) Solvent-controlled self-assembly of Fmoc protected aliphatic amino acids. Physical Chemistry Chemical Physics, 25 (16). pp. 11522-11529. ISSN 1463-9084

Leventi, Aristea Anna and Billimoria, Kharmen and Bartczak, Dorota and Laing, Stacey and Goenaga-Infante, Heidi and Faulds, Karen and Graham, Duncan (2023) A new model for quantifying nanoparticle concentration using SERS supported by multi-modal mass spectrometry. Analytical Chemistry, 95 (5). pp. 2757-2764. ISSN 0003-2700

Long, Feng and Wu, Shiyu and Chen, Haitian and Jia, Shuya and Cao, Xincheng and Liu, Peng and Lu, Yanju and Jiang, Jianchun and Zhang, Xiaolei and Xu, Junming (2023) Alcohol production from fatty acids via Ni3Fe/Rutile : revealing the role of oxygen vacancy and metal-support electronic density characteristics. Journal of Catalysis, 428. 115171. ISSN 0021-9517

MacDonald, Peter A. and Banerjee, Sumanta and Kennedy, Alan R. and Mulvey, Robert E. and Robertson, Stuart D. (2023) Structural characterization of the 1-metallo-2- t -butyl-1,2-dihydropyridyl rubidium and caesium complexes. Polyhedron, 234. 116302. ISSN 0277-5387

Maciuk, Sergej and Wood, Susanna H. and Patel, Vipulkumar K. and Shapland, Peter D. P. and Tomkinson, Nicholas C. O. (2023) Peracid oxidation of unactivated sp3 C—H bonds : an important solvent effect. Chemistry - A European Journal, 29 (31). e202204007. ISSN 1521-3765

Massabuau, Fabien C.-P. and Adams, Francesca and Nicol, David and Jarman, John C. and Frentrup, Martin and Roberts, Joseph W. and O'Hanlon, Thomas J. and Kovács, Andras and Chalker, Paul R. and Oliver, R. A. (2023) Ni/Au contacts to corundum α-Ga2O3. Japanese Journal of Applied Physics, 62 (SF). SF1008. ISSN 0021-4922

Muir, Kellie and Liggat, John J and O'Keeffe, Luke (2023) Thermal volatilisation analysis of graphite intercalation compound fire retardants. Journal of Thermal Analysis and Calorimetry, 148 (5). pp. 1905-1920.

Price, Robert and MacDonald, Lewis and Gillies, Norman and Day, Alasdair and Brightman, Edward and Li, Jun (2023) Utilisation and valorisation of distillery whisky waste streams via biomass electrolysis : electrosynthesis of hydrogen. Faraday Discussions, 247. pp. 270-290. ISSN 1359-6640

Pruteanu, Ciprian G. and Bannerman, Marcus N. and Kirsz, Marcin and Lue, Leo, Graeme J. Ackland (2023) From atoms to colloids : does the Frenkel line exist in discontinuous potentials? ACS Omega, 8 (13). 12144–12153. ISSN 2470-1343

Ramakrishnan, Maithreyi and van Teijlingen, Alexander and Tuttle, Tell and Ulijn, R. V. (2023) Integrating computation, experiment, and machine learning in the design of peptide-based supramolecular materials and systems. Angewandte Chemie International Edition, 62 (18). e202218067. ISSN 1521-3773

Sahota, Annie and Monteza Cabrejos, Anthony and Kwan, Zoe and Paulose Nadappuram, Binoy and Ivanov, Aleksandar P. and Edel, Joshua B. (2023) Recent advances in single-cell subcellular sampling. Chemical Communications, 59 (36). pp. 5312-5328. ISSN 1359-7345

Swanson, Hamish W. A. and Lau, King Hang Aaron and Tuttle, Tell (2023) Minimal peptoid dynamics inform self-assembly propensity. Journal of Physical Chemistry B, 127 (49). 10601–10614. ISSN 1520-6106

Tongu, Sylvester M. and Sha’Ato, Rufus and Wase, Geoffrey A. and Okonkwo, Jonathan O. and Vesuwe, Rebecca N. (2023) Organochlorine pesticides and polychlorinated biphenyls in city drains in Makurdi, central Nigeria : seasonal variations, source apportionment and risk assessment. Heliyon, 9 (3). e14324. ISSN 2405-8440

Vuong, Van-Quan and Cevallos, Caterina and Hourahine, Ben and Aradi, Bálint and Jakowski, Jacek and Irle, Stephan and Camacho, Cristopher (2023) Accelerating the density-functional tight-binding method using graphical processing units. Journal of Chemical Physics, 158 (8). 084802. ISSN 0021-9606

Wang, Linlin and Simmchen, Juliane (2023) Determination of the swimming mechanism of Au@TiO2 active matter and implications on active–passive interactions. Soft Matter, 19 (3). pp. 540-549. ISSN 1744-6848

Watts, M. J. and Argyraki, A. and Barbieri, M. and Brown, A. and Button, M. and Finkelman, R. and Gibson, G. and Humphrey, O. and Huo, X. and Hursthouse, A. S. and Kaninga, B. and Marinho Reis, P. and Middleton, D. R. S. and Morton-Bermea, O. and Nazarpour, A. and Olatunji, A. S. and Osano, O. and Potgieter-Vermaak, S. and Prater, C. and Torrance, K. and Wong, M. H. and Zhang, C. and Zia, M. (2023) Editorial : the Society for Environmental Geochemistry and Health (SEGH): 50 years and beyond. Environmental Geochemistry and Health, 45 (4). pp. 1165-1171. ISSN 0269-4042

Williams, Jason D. and Leach, Stuart G. and Kerr, William J. (2023) An umpolung approach to acyclic 1,4-dicarbonyl amides via photoredox-generated carbamoyl radicals. Chemistry - A European Journal, 29 (28). e202300403. ISSN 1521-3765

Wittmann, Martin and Voigtmann, Maximilian and Simmchen, Juliane (2023) Active BiVO 4 swimmers propelled by depletion gradients caused by photodeposition. Small, 19 (15). 2206885. ISSN 1613-6810

Zou, Jiajia and Stammers, Ashley C. and Taladriz-Sender, Andrea and Withers, Jamie M. and Christie, Iain and Santana Vega, Marina and Aekbote, Badri L. and Peveler, William J. and Rusling, David A. and Burley, Glenn A. and Clark, Alasdair W. (2023) Fluorous-directed assembly of DNA origami nanostructures. ACS Nano, 17 (1). 752–759. ISSN 1936-0851

van Teijlingen, Alexander and Smith, Melissa C. and Tuttle, Tell (2023) Short peptide self-assembly in the Martini coarse grain forcefield family. Accounts of Chemical Research, 56 (6). pp. 644-654. ISSN 0001-4842

2022

Clarke, Rebecca G. and Weatherston, Jake and Taj-Aldeen, Rafid A. and Waddell, Paul G. and McFarlane, William and Penfold, Thomas J. and Bogaerts, Jonathan and MacKenzie, Lewis E. and Herrebout, Wouter and Pal, Robert and Hall, Michael J. (2022) Synthesis and structural diversification of circularly polarised luminescence active, helically chiral, "confused" N,N,O,C‐BODIPYs**. ChemPhotoChem. e202200194. ISSN 2367-0932

Damiati, Laila A. and El-Yaagoubi, Marwa and Damiati, Safa A. and Kodzius, Rimantas and Sefat, Farshid and Damiati, Samar (2022) Role of polymers in microfluidic devices. Polymers, 14 (23). 5132. ISSN 2073-4360

Franke, Christian and Chum, Tomáš and Kvíčalová, Zuzana and Glatzová, Daniela and Gentsch, Gregor Jörg and Rodriguez, Alvaro and Helmerich, Dominic A. and Herdly, Lucas and Mavila, Harsha and Frank, Otakar and Brdička, Tomáš and van de Linde, Sebastian and Cebecauer, Marek (2022) Approach to map nanotopography of cell surface receptors. Communications Biology, 5 (1). 218. ISSN 2399-3642

Grassia, Paul (2022) Electro-osmotic and viscous effects upon pressure to drive a droplet through a capillary. Proceedings of the Royal Society A : Mathematical, Physical and Engineering Sciences, 478 (2258). 20210801. ISSN 1471-2962

Guo, Chao and Chadwick, Robert J. and Foulis, Adam and Bedendi, Giada and Lubskyy, Andriy and Rodriguez, Kyle J. and Pellizzoni, Michaela M. and Milton, Ross D. and Beveridge, Rebecca and Bruns, Nico (2022) Peroxidase activity of myoglobin variants reconstituted with artificial cofactors. Chembiochem, 23 (18). e202200197. ISSN 1439-4227

Khatchenko, Yu E. and Yakushev, M.V. and Seibel, C. and Bentmann, H. and Orlita, M. and Golyashov, V. and Ponosov, Y.S. and Stepina, N.P. and Mudryi, A.V. and Kokh, K.A. and Tereshchenko, O.E. and Reinert, F. and Martin, R.W. and Kuznetsova, T.V. (2022) Structural, optical and electronic properties of the wide bandgap topological insulator Bi1.1Sb0.9Te2S. Journal of Alloys and Compounds, 890. 161824. ISSN 0925-8388

Kobylarski, Marie and Donnelly, Liam J. and Berthet, Jean Claude and Cantat, Thibault (2022) Zirconium-catalysed hydrosilylation of esters and depolymerisation of polyester plastic waste. Green Chemistry, 24 (18). pp. 6810-6815. ISSN 1463-9262

Man, Ernest and Lamprou, Dimitrios and Easdon, Claire and McLellan, Iain and Yiu, Humphrey H. P. and Hoskins, Clare (2022) Exploration of dual ionic cross-linked alginate hydrogels via cations of varying valences towards wound healing. Polymers, 14 (23). 5192. ISSN 2073-4360

Mastropierro, Pasquale and Kennedy, Alan R. and Hevia, Eva (2022) Metallation of sensitive fluoroarenes using a potassium TMP-zincate supported by a silyl(bis)amido ligand. Chemical Communications, 58 (34). pp. 5292-5295. ISSN 1359-7345

McLean, Caitlin and Brown, Kelly and Windmill, James and Dennany, Lynn (2022) Innovations in point-of-care electrochemical detection of Pyocyanin. Journal of Electroanalytical Chemistry, 921. 116649. ISSN 0022-0728

McQueen, Ewan and Bai, Yang and Sprick, Reiner Sebastian (2022) Impact of interfaces, and nanostructure on the performance of conjugated polymer photocatalysts for hydrogen production from water. Nanomaterials, 12 (23). 4299. ISSN 2079-4991

Sharif, Sadia and Ahmad, Zahoor and Hoskins, Clare and Choudhary, Muhammad Aziz and Mehmood, Arshad (2022) Ag nanostructure morphologies and physicochemical properties dictated by the polyols used in the synthesis. Journal of Nano Research, 76. pp. 93-106. ISSN 1661-9897

Stachelek, Patrycja and MacKenzie, Lewis and Parker, David and Pal, Robert (2022) Circularly polarised luminescence laser scanning confocal microscopy to study live cell chiral molecular interactions. Nature Communications, 13. 553. ISSN 2041-1723

2021

Boccorh, Delali K. and MacDonald, Peter A. and Boyle, Colm W. and Wain, Andrew J. and Berlouis, Leonard E. A. and Wark, Alastair W. (2021) A universal polymer shell-isolated nanoparticle (SHIN) design for single particle spectro-electrochemical SERS sensing using different core shapes. Nanoscale Advances, 3 (22). pp. 6415-6426. ISSN 2516-0230

Bruña, Sonia and Kennedy, Alan R. and Fairley, Michael and O'Hara, Charles T. (2021) Facile access to hetero-poly-functional arenes and meta-substituted arenes via two-step dimetalation and Mg/halogen-exchange protocol. Chemistry - A European Journal, 27 (12). pp. 4134-4140. ISSN 1521-3765

Dale, Jessica and Howe, C. Peter and Toncrova, Hedvika and Fritzsch, Robby and Greetham, Gregory M. and Clark, Ian P. and Towrie, Michael and Parker, Anthony W. and McLeish, Thomas C. and Hunt, Neil T. (2021) Combining steady state and temperature jump IR spectroscopy to investigate the allosteric effects of ligand binding to dsDNA. Physical Chemistry Chemical Physics, 23 (28). pp. 15352-15363. ISSN 1463-9084

Davidson, Stuart C. and dos Passos Gomes, Gabriel and Kuhn, Leah R. and Alabugin, Igor V. and Kennedy, Alan and Tomkinson, Nick C.O. (2021) Organocatalytic sulfoxidation. Tetrahedron, 78. 131784. ISSN 0040-4020

Demchuk, Mitchell J. and Zurakowski, Joseph A. and Austen, Brady J. H. and Nelson, David J. and Drover, Marcus W. (2021) Competitive gold/nickel transmetalation. Chemical Communications, 58 (1). pp. 68-71. ISSN 1359-7345

Guilbert, Anne A.Y. and Parr, Zachary S. and Kreouzis, Theo and Woods, Duncan J. and Sprick, Reiner Sebastian and Abrahams, Isaac and Nielsen, Christian B. and Zbiri, Mohamed (2021) Effect of substituting non-polar chains with polar chains on the structural dynamics of small organic molecule and polymer semiconductors. Physical Chemistry Chemical Physics, 23 (12). pp. 7462-7471. ISSN 1463-9084

Lei, Li and Zou, Zhifeng and Liu, Jin and Xu, Zhiai and Fu, Ying and Tian, Yang and Zhang, Wen (2021) Multifunctional peptide-assembled micelles for simultaneously reducing amyloid-β and reactive oxygen species. Chemical Science, 12 (18). pp. 6449-6457. ISSN 2041-6539

Osipov, Mikhail A. and Gorkunov, Maxim V. and Antonov, Alexander A. and Berezkin, Anatoly V. and Kudryavtsev, Yaroslav V. (2021) Liquid-crystal ordering and microphase separation in the lamellar phase of rod-coil-rod triblock copolymers. Molecular theory and computer simulations. Polymers, 13 (19). 3392. ISSN 2073-4360

Zhang, Rui and Liu, Shimin and Fan, Long and Blach, Tomasz P. and Sang, Guijie (2021) Unraveling high-pressure gas storage mechanisms in shale nanopores through SANS. Environmental Science: Nano, 8 (9). pp. 2706-2717. ISSN 2051-8153

2020

Becker, Marc R. and Morack, Tobias and Robertson, Jack and Metternich, Jan B. and Mück-Lichtenfeld, Christian and Daniliuc, Constantin and Burley, Glenn A. and Gilmour, Ryan (2020) Contra-thermodynamic E → Z isomerization of cinnamamides via selective energy transfer catalysis. Tetrahedron, 76 (51). 131198. ISSN 0040-4020

Curle, Jonathan M. and Perieteanu, Marina C. and Humphreys, Philip G. and Kennedy, Alan R. and Tomkinson, Nick C. O. (2020) Alkene syn- and anti-oxyamination with malonoyl peroxides. Organic Letters, 22 (4). pp. 1659-1664. ISSN 1523-7060

Dantanarayana, Varuni and Nematiaram, Tahereh and Vong, Daniel and Anthony, John E. and Troisi, Alessandro and Nguyen Cong, Kien and Goldman, Nir and Faller, Roland (2020) Predictive model of charge mobilities in organic semiconductor small molecules with force-matched potentials. Journal of Chemical Theory and Computation, 16 (6). 3494–3503. ISSN 1549-9618

Ers, Heigo and Lembinen, Meeri and Mišin, Maksim and Seitsonen, Ari P. and Fedorov, Maxim V. and Ivaništšev, Vladislav B. (2020) Graphene–ionic liquid interfacial potential drop from density functional theory-based molecular dynamics simulations. Journal of Physical Chemistry C, 124 (36). pp. 19548-19555. ISSN 1932-7447

Ford, Steven (2020) pH, log P and log D simulations to illustrate physico-chemistry principles. YouTube, [San Jose].

Lane, Paul D. and Reichenbach, Judith and Farrell, Andrew J. and Ramakers, Lennart A.I. and Adamczyk, Katrin and Hunt, Neil T. and Wynne, Klaas (2020) Experimental observation of nanophase segregation in aqueous salt solutions around the predicted liquid-liquid transition in water. Physical Chemistry Chemical Physics, 22 (17). pp. 9438-9447. ISSN 1463-9084

Langer, Judith and Jimenez De Aberasturi, Dorleta and Aizpurua, Javier and Alvarez-Puebla, Ramon A. and Auguié, Baptiste and Baumberg, Jeremy J. and Bazan, Guillermo C. and Bell, Steven E.J. and Boisen, Anja and Brolo, Alexandre G. and Choo, Jaebum and Cialla-May, Dana and Deckert, Volker and Fabris, Laura and Faulds, Karen and García De Abajo, F. Javier and Goodacre, Royston and Graham, Duncan and Haes, Amanda J. and Haynes, Christy L. and Huck, Christian and Itoh, Tamitake and Käll, Mikael and Kneipp, Janina and Kotov, Nicholas A. and Kuang, Hua and Le Ru, Eric C. and Lee, Hiang Kwee and Li, Jian Feng and Ling, Xing Yi and Maier, Stefan A. and Mayerhöfer, Thomas and Moskovits, Martin and Murakoshi, Kei and Nam, Jwa Min and Nie, Shuming and Ozaki, Yukihiro and Pastoriza-Santos, Isabel and Perez-Juste, Jorge and Popp, Juergen and Pucci, Annemarie and Reich, Stephanie and Ren, Bin and Schatz, George C. and Shegai, Timur and Schlücker, Sebastian and Tay, Li Lin and Thomas, K. George and Tian, Zhong Qun and Van Duyne, Richard P. and Vo-Dinh, Tuan and Wang, Yue and Willets, Katherine A. and Xu, Chuanlai and Xu, Hongxing and Xu, Yikai and Yamamoto, Yuko S. and Zhao, Bing and Liz-Marzán, Luis M. (2020) Present and future of surface-enhanced Raman scattering. ACS Nano, 14 (1). pp. 28-117. ISSN 1936-0851

Mullani, Sajid B. and Dhodamani, Abanta G. and Shellikeri, Annadanesh and Mullani, Navaj B. and Tawade, Anita K. and Tavade, Shivaji N. and Biscay, Julien and Dennany, Lynn and Delekar, Sagar D. (2020) Structural refinement and electrochemical properties of one dimensional (ZnO NRs)1-x(CNs )x functional hybrids for serotonin sensing studies. Scientific Reports, 10 (1). 15955. ISSN 2045-2322

Nematiaram, Tahereh and Padula, Daniele and Landi, Alessandro and Troisi, Alessandro (2020) On the largest possible mobility of molecular semiconductors and how to achieve it. Advanced Functional Materials, 30 (30). 2001906. ISSN 1616-301X

Nematiaram, Tahereh and Troisi, Alessandro (2020) Modeling charge transport in high-mobility molecular semiconductors : balancing electronic structure and quantum dynamics methods with the help of experiments. Journal of Chemical Physics, 152 (19). 190902. ISSN 0021-9606

Nematiaram, Tahereh and Troisi, Alessandro (2020) Strategies to reduce the dynamic disorder in molecular semiconductors. Materials Horizons, 7 (11). pp. 2922-2928. ISSN 2051-6355

Panagopoulou, Maria S. and Wark, Alastair W. and Birch, David J.S. and Gregory, Christopher D. (2020) Phenotypic analysis of extracellular vesicles : a review on the applications of fluorescence. Journal of Extracellular Vesicles, 9 (1). 1710020. ISSN 2001-3078

Patterson, Sarah J.M. and Clark, Peter R. and Williams, Glynn D. and Tomkinson, Nicholas C.O. (2020) An azide and acetylene free synthesis of 1-substituted 1,2,3-triazoles. Tetrahedron Letters, 61 (45). 152483. ISSN 0040-4039

Timofeeva, Daria S. and Lindsay, David M. and Kerr, William J. and Nelson, David J. (2020) Quantitative prediction of selectivity in iridium-catalysed hydrogen isotope exchange reactions. ChemRxiv, [London].

2019

Ben Yaala, Marwa and Saeedi, Arsalan and Scherrer, Dan-Felix and Moser, Lucas and Steiner, Roland and Zutter, Marco and Oberkofler, Martin and De Temmerman, Gregory and Marot, Laurent and Meyer, Ernst (2019) Plasma-assisted catalytic formation of ammonia in N 2–H 2 plasma on a tungsten surface. Physical Chemistry Chemical Physics, 21 (30). pp. 16623-16633. ISSN 1463-9084

Bole, Leonie J. and Davin, Laia and Kennedy, Alan R. and McLellan, Ross and Hevia, Eva (2019) Magnesium-mediated arylation of amines via C-F bond activation of fluoroarenes. Chemical Communications, 55 (30). pp. 4339-4342. ISSN 1359-7345

Davin, Laia and Hernán-Gómez, Alberto and McLaughlin, Calum and Kennedy, Alan R. and McLellan, Ross and Hevia, Eva (2019) Alkali metal and stoichiometric effects in intermolecular hydroamination catalysed by lithium, sodium and potassium magnesiates. Dalton Transactions, 48 (23). pp. 8122-8130. ISSN 1477-9226

Finlayson, Duncan and Rinaldi, Christopher and Baker, Matthew J. (2019) Is infrared spectroscopy ready for the clinic? Analytical Chemistry, 91 (19). pp. 12117-12128. ISSN 0003-2700

Livingstone, Keith and Tenberge, Marius and Pape, Felix and Daniliuc, Constantin G. and Jamieson, Craig and Gilmour, Ryan (2019) Photocatalytic E→Z Isomerization of β-Ionyl Derivatives. Organic Letters, 21 (23). pp. 9677-9680. ISSN 1523-7060

Rohrbach, Simon and Smith, Andrew J. and Pang, Jia Hao and Poole, Darren L. and Tuttle, Tell and Chiba, Shunsuke and Murphy, John A. (2019) Konzertierte nukleophile aromatische Substitutionen. Angewandte Chemie, 131 (46). pp. 16518-16540. ISSN 1521-3773

Russell, Ben A. and Kubiak-Ossowska, Karina and Chen, Yu and Mulheran, Paul A. (2019) Critical role of tyrosine-20 in formation of gold nanoclusters within lysozyme : a molecular dynamics study. Physical Chemistry Chemical Physics, 21 (9). pp. 4907-4911. ISSN 1463-9084

Sagagi, Balarabe S and Davidson, Christine M and Hursthouse, Andrew S (2019) Adaptation of the BCR sequential extraction procedure for fractionation of potentially toxic elements in airborne particulate matter collected during routine air quality monitoring. International Journal of Environmental Analytical Chemistry. ISSN 0306-7319

Ulrich, Sebastian and Osypova, Alina and Panzarasa, Guido and Rossi, René M. and Bruns, Nico and Boesel, Luciano F. (2019) Pyranine-modified amphiphilic polymer conetworks as fluorescent ratiometric pH sensors. Macromolecular Rapid Communications, 40 (21). 1900360. ISSN 1022-1336

2018

Allan, Pamela and Arlin, Jean-Baptiste and Kennedy, Alan R. and Walls, Aiden (2018) Mixed Ca/Sr salt forms of salicylic acid, tuning structure and aqueous solubility. Acta Crystallographica Section C: Structural Chemistry, C74 (2). pp. 131-138. ISSN 2053-2296

Bogdos, Michael K. and Pinard, Emmanuel and Murphy, John A. (2018) Applications of organocatalysed visible-light redox reactions for medicinal chemistry. Beilstein Journal of Organic Chemistry, 2018 (14). pp. 2035-2064. ISSN 1860-5397

Cumine, Florimond and Palumbo, Fabrizio and Murphy, John A. (2018) Reduction of nitroarenes, azoarenes and hydrazine derivatives by an organic electron donor. Tetrahedron, 74 (38). pp. 5539-5545. ISSN 0040-4020

Dias Mirandela, Gaëtan and Tamburrino, Giulia and Ivanović, Miloš T. and Strnad, Felix M. and Byron, Olwyn and Rasmussen, Tim and Hoskisson, Paul A. and Hub, Jochen S. and Zachariae, Ulrich and Gabel, Frank and Javelle, Arnaud (2018) Merging in-solution X-ray and neutron scattering data allows fine structural analysis of membrane-protein detergent complexes. Journal of Physical Chemistry Letters, 9 (14). 3910–3914. ISSN 1948-7185

Molloy, John J. and Seath, Ciaran P. and West, Matthew J. and McLaughlin, Calum and Fazakerley, Neal J. and Kennedy, Alan R. and Nelson, David J. and Watson, Allan J. B. (2018) Interrogating Pd(II) anion metathesis using a bifunctional chemical probe : a transmetalation switch. Journal of the American Chemical Society, 140 (1). pp. 126-130. ISSN 1520-5126

Moores, Matthew and Gracie, Kirsten and Carson, Jake and Faulds, Karen and Graham, Duncan and Girolami, Mark (2018) Bayesian modelling and quantification of Raman spectroscopy. Annals of Applied Statistics. ISSN 1932-6157 (In Press)

Moreira, Inês P. and Scott, Gary G. and Ulijn, Rein V. and Tuttle, Tell (2018) Computational prediction of tripeptide-dipeptide co-assembly. Molecular Physics. ISSN 0026-8976

Nematiaram, Tahereh and Mayou, Didier; Zaidi, Beddiaf, ed. (2018) Quantum two-level model for excitonic solar cells. In: Solar Panels and Photovoltaic Materials. IntechOpen Limited, London. ISBN 9781789234350

Payne, Julia L. and Ni, Chengsheng and Harwell, Jonathon R. and Jagadamma, Lethy Krishnan and McDonald, Calum and Mariotti, Davide and Samuel, Ifor D. W. and Irvine, John T. S. (2018) Probing the structure–property–composition relationship in organic–inorganic tri-halide perovskites. Physical Chemistry Chemical Physics, 20 (31). pp. 20489-20496. ISSN 1463-9084

Rachor, Simon G. and Cleaves, Peter A. and Robertson, Stuart D. and Mansell, Stephen M. (2018) NMR spectroscopic study of the adduct formation and reactivity of homoleptic rare earth amides with alkali metal benzyl compounds, and the crystal structures of [Li(TMEDA)2][Nd{N(SiMe3)2}3(CH2Ph)] and [{Li(TMP)}2{Li(Ph)}]2. Journal of Organometallic Chemistry, 857. pp. 101-109. ISSN 0022-328X

Sosnin, Sergey and Misin, Maksim and Palmer, David S. and Fedorov, Maxim V. (2018) 3D matters! 3D-RISM and 3D convolutional neural network for accurate bioaccumulation prediction. Journal of Physics: Condensed Matter, 30. 32LT03. ISSN 0953-8984

Sousa, Ana M. L. and Li, Tai-De and Varghese, Sabu and Halling, Peter J. and Lau, King Hang Aaron (2018) Highly active protein surfaces enabled by plant-based polyphenol coatings. ACS Applied Materials and Interfaces, 10 (45). pp. 39353-39362. ISSN 1944-8252

Turner, Oliver J. and Murphy, John A. and Hirst, David J. and Talbot, Eric P. A. (2018) Hydrogen atom transfer‐mediated cyclisations of nitriles. Chemistry - A European Journal, 24 (70). 18658–18662. ISSN 1521-3765

Yu, Hui and Yue, Hong and Halling, Peter (2018) Robust sampling time design for biochemical systems. IFAC-PapersOnLine, 51 (18). pp. 215-220. ISSN 2405-8963

2017

Cameron, Robert P. and Goette, Jörg B. and Barnett, Stephen M. and Yao, Alison M. (2017) Chirality and the angular momentum of light. Philosophical Transactions A: Mathematical, Physical and Engineering Sciences, 375 (2087). 20150433. ISSN 1471-2962

Campbell, Christopher and Ferreiro-Rangel, Carlos A. and Fischer, Michael and Gomes, José R. B. and Jorge, Miguel (2017) A transferable model for adsorption in MOFs with unsaturated metal sites. Journal of Physical Chemistry C, 121 (1). 441−458. ISSN 1932-7447

Couture, Maxime and Brule, Thibault and Laing, Stacey and Cui, Wenli and Sarkar, Mitradeep and Charron, Benjamin and Faulds, Karen and Peng, Wei and Canva, Michael and Masson, Jean-Francois (2017) High figure of merit (FOM) of Bragg modes in Au-coated nanodisk arrays for plasmonic sensing. Small, 13 (38). 1700908. ISSN 1613-6810

Kearns, Hayleigh and Goodacre, Royston and Jamieson, Lauren E. and Graham, Duncan and Faulds, Karen (2017) SERS detection of multiple antimicrobial-resistant pathogens using nanosensors. Analytical Chemistry, 89 (23). pp. 12666-12673. ISSN 0003-2700

Khalifa, Mansour and Lue, Leo (2017) A group contribution method for predicting the solubility of mercury. Fluid Phase Equilibria. pp. 76-84. ISSN 0378-3812

Lampel, Ayala and McPhee, Scott A. and Park, Hang-Ah and Scott, Gary G. and Humagain, Sunita and Hekstra, Doeke R. and Yoo, Barney and Frederix, Pim W. J. M. and Li, Tai-De and Abzalimov, Rinat R. and Greenbaum, Steven G. and Tuttle, Tell and Hu, Chunhua and Bettinger, Christopher J. and Ulijn, Rein V. (2017) Polymeric peptide pigments with sequence-encoded properties. Science, 356 (6342). pp. 1064-1068. ISSN 1095-9203

Mulvey, Robert Emmet (2017) Benzene submits to main-group power. Science, 358 (6367). p. 1132. ISSN 0036-8075

Nicolson, Fay and Jamieson, Lauren E. and Mabbott, Samuel and Shand, Neil C. and Graham, Duncan and Faulds, Karen (2017) Through barrier detection of ethanol using handheld Raman spectroscopy — Conventional Raman versus spatially offset Raman spectroscopy (SORS). Journal of Raman Spectroscopy, 48 (12). pp. 1828-1838. ISSN 0377-0486

Osipov, M. A. and Pająk, G. (2017) Polar interactions between bent–core molecules as a stabilising factor for inhomogeneous nematic phases with spontaneous bend deformations. Liquid Crystals, 44 (1). pp. 58-67. ISSN 0267-8292

Sloan-Dennison, Sian and Laing, Stacey and Shand, Neil C. and Graham, Duncan and Faulds, Karen (2017) A novel nanozyme assay utilising the catalytic activity of silver nanoparticles and SERRS. Analyst, 142 (13). pp. 2484-2490. ISSN 0003-2654

Sloan-Dennison, Sian and Shand, Neil C. and Graham, Duncan and Faulds, Karen (2017) Resonance Raman detection of antioxidants using an iron oxide nanoparticle catalysed decolourisation assay. Analyst, 142 (24). pp. 4715-4720. ISSN 0003-2654

2016

Antwi, B. Y. and Taylor, R. G. D. and Cameron, J. and Owoare, R. B. and Kingsford-Adaboh, R. and Skabara, P. J. (2016) Acceptor-donor-acceptor small molecules based on derivatives of 3,4-ethylenedioxythiophene for solution processed organic solar cells. RSC Advances, 6 (101). pp. 98797-98803. ISSN 2046-2069

Conn, Justin J. A. and Duffy, Brian R. and Pritchard, David and Wilson, Stephen K. and Halling, Peter J. and Sefiane, Khellil (2016) Fluid-dynamical model for antisurfactants. Physical Review E, 93 (4). 043121. ISSN 2470-0053

Fritzsch, Robby and Brady, Owen and Adair, Elaine and Wright, Joseph A. and Pickett, Christopher J. and Hunt, Neil (2016) Encapsulating Subsite analogues of the [FeFe]-hydrogenases in micelles enables direct water interactions. Journal of Physical Chemistry Letters, 7. pp. 2838-2843. ISSN 1948-7185

Jenz, Frank and Osipov, Mikhail A. and Jagiella, Stefan and Giesselmann, Frank (2016) Orientational distribution functions and order parameters in "de Vries"-type smectics : a simulation study. Journal of Chemical Physics, 145 (13). 134901. ISSN 0021-9606

Mabbott, Samuel and Thompson, David and Sirimuthu, Narayana and McNay, Graeme and Faulds, Karen and Graham, Duncan (2016) From synthetic DNA to PCR product : detection of fungal infections using SERS. Faraday Discussions, 187. pp. 461-472. ISSN 1359-6640

McPherson, Christopher G. and Livingstone, Keith and Jamieson, Craig and Simpson, Iain (2016) Palladium-catalyzed synthesis of aryl amides through silanoate-mediated hydrolysis of nitriles. Synlett, 27 (1). pp. 88-92. ISSN 0936-5214

Misin, Maksim and Vainikka, Petteri A. and Fedorov, Maxim V. and Palmer, David S. (2016) Salting-out effects by pressure-corrected 3D-RISM. Journal of Chemical Physics. ISSN 0021-9606 (In Press)

Ramos Sasselli, I. and Ulijn, R. V. and Tuttle, T. (2016) CHARMM force field parameterization protocol for self-assembling peptide amphiphiles : the Fmoc moiety. Physical Chemistry Chemical Physics, 18 (6). pp. 4659-4667. ISSN 1463-9084

Russell, B. A. and Mulheran, P. A. and Birch, D. J. S. and Chen, Y. (2016) Probing the sudlow binding site with warfarin : how does gold nanocluster growth alter human serum albumin? Physical Chemistry Chemical Physics, 18 (33). pp. 22874-22878. ISSN 1463-9084

Sasselli, I.R. and Pappas, C. G. and Matthews, E. and Wang, T. and Hunt, Neil and Ulijn, Rein and Tuttle, Christopher (2016) Using experimental and computational energy equilibration to understand hierarchical self-assembly of Fmoc-dipeptide amphiphiles. Soft Matter, 2016 (40). pp. 8307-8315. ISSN 1744-6848

Silverwood, I. P. and Al-Rifai, N. and Cao, E. and Nelson, D. J. and Chutia, A. and Wells, P. P. and Nolan, S. P. and Frogley, M. D. and Cinque, G. and Gavriilidis, A. and Catlow, C. R. A. (2016) Towards microfluidic reactors for in situ synchrotron infrared studies. Review of Scientific Instruments, 87. 024101. ISSN 0034-6748

Theodoulou, Natalie H. and Bamborough, Paul and Bannister, Andrew J. and Becher, Isabelle and Bit, Rino A. and Che, Ka Hing and Chung, Chun-wa and Dittmann, Antje and Drewes, Gerard and Drewy, David H. and Gordon, Laurie and Grandi, Paola and Leveridge, Melanie and Lindon, Matthew and Michon, Anne-Marie and Molnar, Judit and Robson, Samuel C. and Tomkinson, Nicholas C. O. and Kouzarides, Tony and Prinjha, Rab K. and Humphreys, Philip G. (2016) The discovery of I-BRD9, a selective cell active chemical probe for bromodomain containing protein 9 inhibition. Journal of Medicinal Chemistry, 59 (4). pp. 1425-1439. ISSN 0022-2623

Uzelac, Marina and Kennedy, Alan R. and Hevia, Eva and Mulvey, Robert E. (2016) Transforming LiTMP lithiation of challenging diazines via gallium alkyl trans-metal-trapping. Angewandte Chemie International Edition, 55. pp. 13147-13150. ISSN 1521-3773

2015

Affrossman, Stanley and McKee, Anthony and Pethrick, Richard A. (2015) Effect of surface treatments of titanium dioxide pigments on the cure of polyester/triglycidyl isocyanurate powder coatings. Journal of Coatings Technology Research. ISSN 1547-0091

Baumberg, Jeremy and Nielsen, Michael and Bozhevolnyi, Sergey and Podolskiy, Viktor and Ebbesen, Thomas and Lin, Kaiqiang and Kornyshev, Alexei A. and Khurgin, Jacob and Hutchison, James and Matczyszyn, Katarzyna and George, Jino and Cortes, Emiliano and Hugall, James T. and Salomon, Adi and Dawson, Paul and Martin, Olivier and Kotni, Santhosh and García De Abajo, F. Javier and Flatté, Michael and Moskovits, Martin and Graham, Duncan and Maier, Stefan and Futamata, Masayuki and Oh, Sang Hyun and Aizpurua, Javier and Schultz, Zachary and Sapienza, Riccardo (2015) Surface plasmon enhanced spectroscopies and time and space resolved methods : general discussion. Faraday Discussions, 178. pp. 253-279. ISSN 1359-6640

Caldwell, Stuart T. and Cairns, Andrew G. and Olson, Marnie and Chalmers, Susan and Sandison, Mairi and Mullen, William and McCarron, John G. and Hartley, Richard C. (2015) Synthesis of an azido-tagged low affinity ratiometric calcium sensor. Tetrahedron, 71 (51). 9571–9578. ISSN 0040-4020

García De Abajo, F. Javier and Sapienza, Riccardo and Noginov, Mikhail and Benz, Felix and Baumberg, Jeremy and Maier, Stefan and Graham, Duncan and Aizpurua, Javier and Ebbesen, Thomas and Pinchuk, Anatoliy and Khurgin, Jacob and Matczyszyn, Katarzyna and Hugall, James T. and Van Hulst, Niek and Dawson, Paul and Roberts, Christopher and Nielsen, Michael and Bursi, Luca and Flatté, Michael and Yi, Jun and Hess, Ortwin and Engheta, Nader and Brongersma, Mark and Podolskiy, Viktor and Shalaev, Vladimir and Narimanov, Evgenii and Zayats, Anatoly (2015) Plasmonic and new plasmonic materials : general discussion. Faraday Discussions, 178. pp. 123-149. ISSN 1359-6640

Hunt, Neil and Wright, Joseph and Pickett, Christopher (2015) Detection of transient intermediates generated from subsite analogues of [FeFe]-hydrogenases. Inorganic Chemistry, 2016 (55). pp. 399-410. ISSN 1520-510X

Maddock, Lewis C H and Cadenbach, Thomas and Kennedy, Alan R. and Borilovic, Ivana and Aromí, Guillem and Hevia, Eva (2015) Accessing Sodium Ferrate complexes containing neutral and anionic N-heterocyclic carbene ligands : structural, synthetic, and magnetic insights. Inorganic Chemistry, 54 (18). pp. 9201-9210. ISSN 1520-510X

Marshall, William G. and Urquhart, Andrew J. and Oswald, Iain D.H. (2015) Investigation of methacrylic acid at high pressure using neutron diffraction. Journal of Physical Chemistry B, 119 (36). pp. 12147-12154. ISSN 1520-6106

Nelson, David J. (2015) Accessible syntheses of late transition metal (pre-)catalysts bearing N-heterocyclic carbene ligands. European Journal of Inorganic Chemistry. ISSN 1434-1948

Pappas, Charalampos G. and Mutasa, Tapiwa and Frederix, Pim W. J. M. and Fleming, Scott and Bia, Shuo and Debnath, Sisir and Kelly, Sharon M. and Gachagan, Anthony and Ulijn, Rein V. (2015) Transient supramolecular reconfiguration of peptide nanostructures using ultrasound. Materials Horizons, 2 (2). pp. 198-202. ISSN 2051-6355

Robinson, David and Baker, Matthew J. and Bedford, Clare and Perry, Jennifer and Wienhold, Michelle and Bernard, Julienne and Reeves, Dan and Kotoula, Eleni and Gandy, Devlin and Miles, James (2015) Methodological considerations of integrating portable digital technologies in the analysis and management of complex superimposed Californian pictographs : from spectroscopy and spectral imaging to 3-D scanning. Digital Applications in Archaeology and Cultural Heritage. ISSN 2212-0548

Rubinson, M. A. and Parkinson, J. A. and Evstigneev, M. P. (2015) Entropic binding mode preference in cooperative homo-dimeric drug-DNA recognition. Chemical Physics Letters, 624. pp. 12-14. ISSN 0009-2614

Russell, B. A. and Kubiak-Ossowska, K. and Mulheran, P. A. and Birch, D. J. S. and Chen, Y. (2015) Locating the nucleation sites for protein encapsulated gold nanoclusters : a molecular dynamics and fluorescence study. Physical Chemistry Chemical Physics, 17 (34). pp. 21935-21941. ISSN 1463-9084

Shaw, Daniel J. and Adamczyk, Katrin and Frederix, Pim W. J. M. and Simpson, Niall and Robb, Kirsty and Greetham, Gregory M. and Towrie, Michael and Parker, Anthony W. and Hoskisson, Paul A. and Hunt, Neil T. (2015) Multidimensional infrared spectroscopy reveals the vibrational and solvation dynamics of isoniazid. Journal of Chemical Physics, 142 (21). 212401. ISSN 0021-9606

2014

Baillie, Sharon E. and Bluemke, Tobias D. and Clegg, William and Kennedy, Alan R. and Klett, Jan and Russo, Luca and De Tullio, Marco and Hevia, Eva (2014) Potassium-alkyl magnesiates : synthesis, structures and Mg-H exchange applications of aromatic and heterocyclic substrates. Chemical Communications, 50. pp. 12859-12862. ISSN 1359-7345

Cheung, David L. (2014) Complex molecules at liquid interfaces : insights from molecular simulation. Advances in Chemistry, 2014. pp. 1-12. 567180. ISSN 2314-7571

Chreifi, Georges and Li, Huiying and McInnes, Craig and Gibson, Colin and Suckling, Colin and Poulos, Thomas L (2014) Communication between the zinc and tetrahydrobiopterin binding sites in nitric oxide synthase. Biochemistry. ISSN 0006-2960

Fyfe, James W. B. and Seath, Ciaran P. and Watson, Allan J. B. (2014) Chemoselective boronic ester synthesis via controlled speciation. Angewandte Chemie, 53 (45). 12077–12080. ISSN 1521-3773

Gomes, Jose R. B. and Jorge, Miguel and Gomes, Paula (2014) Interaction of chitosan and chitin with Ni, Cu and Zn ions : a computational study. Journal of Chemical Thermodynamics, 73. pp. 121-129. ISSN 0021-9614

Haughey, Anne-Marie and Foucher, Caroline and Guilhabert, Benoit and Kanibolotsky, Alexander L. and Skabara, Peter J. and Burley, Glenn and Dawson, Martin D. and Laurand, Nicolas (2014) Hybrid organic semiconductor lasers for bio-molecular sensing. Faraday Discussions, 174. pp. 369-381. ISSN 1359-6640

Hidding, Bernhard and Klapötke, Thomas and Kornath, Andreas and Zhu, Xiaomin (2014) State of silanes. International Innovation (148). pp. 41-43. ISSN 2054-6254

Johnston, Blair F. and Marshall, William G. and Parsons, Simon and Urquhart, Andrew J. and Oswald, Iain D. H. (2014) Investigation of acrylic acid at high pressure using neutron diffraction. Journal of Physical Chemistry B, 118 (14). pp. 4044-4051. ISSN 1520-6106

Kerr, William J and Mudd, Richard J and Paterson, Laura and Brown, Jack (2014) Iridium(I)-catalyzed Regioselective C-H Activation and Hydrogen Isotope Exchange of Non-aromatic Unsaturated Functionality. Chemistry - A European Journal. ISSN 1521-3765

Li, Xiaohui and Ren, Jinchang and Zhao, Chunhui and Qiao, Tong and Marshall, Stephen (2014) Novel multivariate vector quantization for effective compression of hyperspectral imagery. Optics Communications, 332. pp. 192-200. OPTICS19339. ISSN 0030-4018

Manzini, Simone and Poater, Albert and Nelson, David J and Cavallo, Luigi and Slawin, Alexandra M Z and Nolan, Steven P (2014) Insights into the decomposition of olefin metathesis precatalysts. Angewandte Chemie International Edition. ISSN 1521-3773

McAughtrie, Sarah Louise and Faulds, Karen and Graham, Duncan (2014) Surface enhanced Raman spectroscopy (SERS) : potential applications for disease detection and treatment. Journal of Photochemistry and Photobiology C: Photochemistry Reviews, 21. pp. 40-53.

Nalluri, Siva Krishna Mohan and Shivarova, Nadezhda and Kanibolotsky, Alexander L. and Zelzer, Mischa and Gupta, Swati and Frederix, Pim and Skabara, Peter J. and Gleskova, Helena and Ulijn, Rein V. (2014) Conducting nanofibers and organogels derived from the self-assembly of tetrathiafulvalene-appended dipeptides. Langmuir, 30 (41). pp. 12429-12437. ISSN 0743-7463

Rajasekharan Nair, Rajeev and Moore, Dean and Spicer, Mark and Reglinski, John and Kennedy, Alan (2014) The stability of mercaptobenzothiazole based soft scorpionate complexes. Inorganic Chemistry, 53 (19). 10276–10282. ISSN 1520-510X

Salammal, S.T. and Balandier, J.-Y. and Arlin, J.-B. and Olivier, Y. and Lemaur, V. and Wang, L. and Beljonne, D. and Cornil, J. and Kennedy, A.R. and Geerts, Y.H. and Chattopadhyay, B. (2014) Polymorphism in bulk and thin films : the curious case of dithiophene-DPP(Boc)-dithiophene. Journal of Physical Chemistry C, 118 (1). pp. 657-669. ISSN 1932-7447

Smith, M. D. and Taylor, E. and Sadler, T. C. and Zubialevich, V. Z. and Lorenz, K. and Li, H. N. and O'Connell, J. and Alves, E. and Holmes, J. D. and Martin, R. W. and Parbrook, P. J. (2014) Determination of Ga auto-incorporation in nominal InAlN epilayers grown by MOCVD. Journal of Materials Chemistry. C, 2 (29). pp. 5787-5792. ISSN 2050-7526

Yang, Huaiyu and Rasmuson, Åke C. (2014) Ternary phase diagrams of ethyl paraben and propyl paraben in ethanol aqueous solvents. Fluid Phase Equilibria, 376. pp. 69-75. ISSN 0378-3812

2013

Alvarez-Dorta, Dimitri and Leon, E.I. and Kennedy, Alan and Martin, Angeles and Perez-Martin, I. and Riesco-Fagundo, Concepcion and Suarez, Ernesto (2013) Sequential Norrish Type II photoelimination and intramolecular Aldol cyclization of alpha-diketones : synthesis of polyhydroxylated cyclopentitols by ring contraction of hexopyranose carbohydrate derivatives. Chemistry - A European Journal, 19 (31). pp. 10312-10333. ISSN 1521-3765

Fleming, Scott and Debnath, Sisir and Frederix, Pim W J M and Tuttle, Tell and Ulijn, Rein V (2013) Aromatic peptide amphiphiles: significance of the Fmoc moiety. Chemical Communications, 49 (90). pp. 10587-10589.

Futamura, Ryusuke and Jorge, Miguel and Gomes, José R B (2013) Role of the organic linker in the early stages of the templated synthesis of PMOs. Physical Chemistry Chemical Physics, 15 (17). pp. 6166-6169. ISSN 1463-9084

Gaca, K.Z. and Parkinson, J.A. and Sefcik, J. (2013) Molecular speciation and mesoscale clustering in formaldehyde-methanol- water solutions in the presence of sodium carbonate. Journal of Physical Chemistry B, 117 (36). pp. 10548-10555. ISSN 1520-6106

Moreno-Fuquen, Rodolfo and Hernandez, Geraldine and Kennedy, Alan and Morrison, Catriona A. (2013) Supramolecular study, Hirshfeld analysis and theoretical study of 6-methoxyquinoline N-oxide dihydrate. Acta Crystallographica Section C: Crystal Structure Communications, 69 (6). pp. 665-670. ISSN 0108-2701

Prylutskyy, Yuriy I. and Buchelnikov, Anatoly S. and Voronin, Dmitry P. and Kostjukov, Viktor V. and Ritter, Uwe and Parkinson, John A. and Evstigneev, Maxim P. (2013) C60 fullerene aggregation in aqueous solution. Physical Chemistry Chemical Physics, 15 (23). pp. 9351-9360. ISSN 1463-9084

Simpson, Niall and Shaw, Daniel J. and Frederix, Pim W J M and Gillies, Audrey H. and Adamczyk, Katrin and Greetham, Gregory M. and Towrie, Michael and Parker, Anthony William and Hoskisson, Paul A. and Hunt, Neil T. (2013) Infrared spectroscopy of nicotinamide adenine dinucleotides in one and two dimensions. Journal of Physical Chemistry B, 117 (51). pp. 16468-16478. ISSN 1520-6106

Su, Wu and Bagshaw, Clive R. and Burley, Glenn A. (2013) Addressable and unidirectional energy transfer along a DNA three-way junction programmed by pyrrole-imidazole polyamides. Scientific Reports, 3. 1883. ISSN 2045-2322

2012

Arlin, Jean-Baptiste and Kennedy, Alan (2012) Alkaline earth metal salts of 1-naphthoic acid. Acta Crystallographica Section C: Crystal Structure Communications, 68. M213-+. ISSN 0108-2701

Arlin, Jean-Baptiste and Kennedy, Alan and Shankland, Kenneth (2012) Magnesium, calcium and strontium salts of phenylacetic acid. Acta Crystallographica Section C: Crystal Structure Communications, 68. M29-M33. ISSN 0108-2701

Baillie, Sharon E. and Blair, Victoria L. and Blakemore, David C. and Hay, Duncan and Kennedy, Alan and Pryde, David C. and Hevia, Eva (2012) New lithium-zincate approaches for the selective functionalisation of pyrazine: direct dideprotozincation vs. nucleophilic alkylation. Chemical Communications, 48 (14). pp. 1985-1987. ISSN 1359-7345

Baillie, Sharon E. and Clegg, William and Garcia-Alvarez, Pablo and Hevia, Eva and Klett, Jan and Russo, Luca and Kennedy, Alan (2012) Synthesis, structural elucidation, and diffusion-ordered NMR studies of homoleptic alkyllithium magnesiates: donor-controlled structural variations in mixed-metal chemistry. Organometallics, 31 (14). pp. 5131-5142. ISSN 0276-7333

Berlouis, Leonard (2012) Progress in redox flow batteries, remaining challenges and their applications in energy storage. RSC Advances, 2 (27). pp. 10125-10156. ISSN 2046-2069

Bratkowska, Dominika and Davies, Arlene and Fontanals Torroja, Nuria and Cormack, Peter and Borrull, Francesc and Sherrington, David and Marcé, Rosa Maria (2012) Hypercrosslinked strong anion-exchange resin for extraction of acidic pharmaceuticals from environmental water. Journal of Separation Science, 35. pp. 2621-2628. ISSN 1615-9306

Busby, G. B. J. and Brisighelli, F. and Sanchez-Diz, P. and Ramos-Luis, E. and Martinez-Cadenas, C. and Thomas, M. G. and Bradley, D. G. and Gusmao, L. and Winney, B. and Bodmer, W. and Vennemann, Marielle (2012) The peopling of Europe and the cautionary tale of Y chromosome lineage R-M269. Proceedings- Royal Society of London B, 279. pp. 884-892. ISSN 0962-8452

Cabeza, Javier A. and Damonte, Marina and Garcia-Alvarez, Pablo and Guadalupe Hernandez-Cruz, M. and Kennedy, Alan (2012) Reactivity of phosphine- and thioether-tethered N-heterocyclic carbenes with ruthenium carbonyl. Organometallics, 31 (1). pp. 327-334. ISSN 0276-7333

Clegg, William and Klett, Jan and Mulvey, Robert E. and Russo, Luca and Kennedy, Alan (2012) Adding rubidium and cesium to the homologous series of alkali metal compounds of (Trimethylsilyl)methanides and 2,2,6,6-Tetramethylpiperidides. European Journal of Inorganic Chemistry, 2012 (18). pp. 2989-2994. ISSN 1434-1948

Cortizo Lacalle, Diego and Arumugam, Sasikumar and Elmasly, Saadeldin E. T. and Kanibolotsky, Alexander L. and Findlay, Neil J. and Inigo, Anto Regis and Skabara, Peter J. (2012) Incorporation of fused tetrathiafulvalene units in a DPP-terthiophene copolymer for air stable solution processable organic field effect transistors. Journal of Materials Chemistry, 22 (22). pp. 11310-11315. ISSN 0959-9428

Dennany, Lynn and Stewart, Amy and Stewart, Alasdair James (2012) Electrochemical detection of triacetone triperoxide. In: 6th European Academy of Forensic Science Conference, 2012-08-20 - 2012-08-24.

Devadoss, Anitha and Dennany, Lynn and Dickinson, Calum and Keyes, Tia E and Forster, Robert J. (2012) Highly sensitive detection of NADH using electrochemiluminescent nanocomposites. Electrochemistry Communications, 19. pp. 43-45. ISSN 1388-2481

Fleming, Ben J. and Garcia-Alvarez, Pablo and Keating, Elizabeth and Kennedy, Alan and O'Hara, Charles (2012) Synthesis and structural elucidation of a rare example of a tris(amido) potassium magnesiate. Inorganica Chimica Acta, 384. pp. 154-157. ISSN 0020-1693

Garden, Jennifer A. and Kennedy, Alan R. and Mulvey, Robert E. and Robertson, Stuart D. (2012) Ambient temperature zincation of N-Boc pyrrolidine and its solvent dependency. Chemical Communications, 48 (43). pp. 5265-5267. ISSN 1359-7345

Gupta, Swati and Chinnam, Krishna Chytanya and Zelzer, Mischa and Ulijn, Rein and Gleskova, Helena; Hayden, Oliver and So, Franky and Blom, Paul and Richter, Henning and Park, Jongwook, eds. (2012) Optimizing pentacene growth in low-voltage organic thin-film transistors prepared by dry fabrication techniques. In: 2012 Materials Research Society Spring Meeting - Symposium J – Organic and Hybrid-Organic Electronics. MRS Symposium Proceedings, 1435 . Materials Research Society, USA.

Harper, Mhairi M. and Robertson, Barry and Ricketts, Alastair and Faulds, Karen (2012) Specific detection of DNA through coupling of a TaqMan assay with surface enhanced Raman scattering (SERS). Chemical Communications, 48 (75). pp. 9412-9414. ISSN 1359-7345

Hatlo, Marius M. and Banerjee, Priyanka and Forsman, Jan and Lue, Leo (2012) Density functional theory for Yukawa fluids. Journal of Chemical Physics, 137 (6). pp. 1-9. 064115. ISSN 0021-9606

Hughes, Meghan and Frederix, Pim W. J. M. and Raeburn, Jaclyn and Birchall, Louise S. and Sadownik, Jan and Coomer, Fiona C. and Lin, I-Hsin and Cussen, Edmund J. and Hunt, Neil T. and Tuttle, Tell and Webb, Simon J. and Adams, Dave J. and Ulijn, Rein V. (2012) Sequence/structure relationships in aromatic dipeptide hydrogels formed under thermodynamic control by enzyme-assisted self-assembly. Soft Matter, 8 (20). pp. 5595-5602. ISSN 1744-6848

Jones, Andrew O. F. and Lemee-Cailleau, Marie-Helene and Martins, David M. S. and McIntyre, Garry J. and Oswald, Iain D. H. and Pulham, Colin R. and Spanswick, Christopher K. and Thomas, Lynne H. and Wilson, Chick C. (2012) Temperature dependent solid-state proton migration in dimethylurea–oxalic acid complexes. Physical Chemistry Chemical Physics, 14 (38). pp. 13273-13283. ISSN 1463-9084

Keating, M. and Chen, Y. and Larmour, I. A. and Faulds, K. and Graham, D. (2012) Growth and surface-enhanced Raman scattering of Ag nanoparticle assembly in agarose gel. Measurement Science and Technology, 23 (8). -. 084006. ISSN 0957-0233

Kennedy, Alan and Morrison, Catriona and Moreno-Fuquen, Rodolfo and Loaiza, A and Diaz-Velandia, J (2012) 1-Benzylpiperidin-4-one O-(2-bromobenzyl)oxime. Acta Crystallographica Section E: Structure Reports, 68. o3039. ISSN 1600-5368

Kerr, William and Forsyth, Calum (2012) Towards the total synthesis of Agariblazeispirol C. In: Challenges in Organic Chemistry and Chemical Biology (ISACS7), 2012-06-12 - 2012-06-15, University of Edinburgh.

Kovacevic, Luka S and Idziak, Christopher and Markevicius, Augustinas and Scullion, Callum and Corr, Michael James and Kennedy, Alan and Tuttle, Tell and Murphy, John A (2012) Superelectrophilic amidine dications : dealkylation by triflate anion. Angewandte Chemie International Edition, 51 (34). pp. 8516-8519. ISSN 1521-3773

Mabbott, Samuel and Larmour, Iain A. and Vishnyakov, Vladimir and Xu, Yun and Graham, Duncan and Goodacre, Royston (2012) The optimisation of facile substrates for surface enhanced Raman scattering through galvanic replacement of silver onto copper. Analyst, 137 (12). pp. 2791-2798. ISSN 0003-2654

Mancini, Annalisa and Pala, Luca and Aragoni, M. Carla and Arca, Massimiliano and Devillanova, Francesco A. and Hursthouse, Michael B. and Light, Mark E. and Skabara, Peter J. and Bricklebank, Neil (2012) Structural and DFT studies of dibromine and diiodine adducts of a sulfur-rich thiocarbonyl donor. European Journal of Inorganic Chemistry, 2012 (14). pp. 2373-2380. ISSN 1434-1948

Mortamet, A. C. and Pethrick, R. A. (2012) Redox initiated free radical polymerization of 4-methylstyrene. Journal of Applied Polymer Science, 123 (3). pp. 1539-1547. ISSN 0021-8995

Okoth, M. O. and Vrcelj, R. M. and Sheen, D. B. and Sherwood, J. N. (2012) Hydration studies of a simple molecular solid. CrystEngComm, 14 (5). pp. 1602-1612. ISSN 1466-8033

Sanchez-Castillo, A. and Osipov, Mikhail A. and Jagiella, S. and Nguyen, Z.H. and Kaspar, M. and Hamplova, V. and Maclennan, J. and Giesselmann, F. (2012) Orientational order parameters of a de Vries–type ferroelectric liquid crystal obtained by polarized Raman spectroscopy and x-ray diffraction. Physical Review E, 85 (6). 061703. ISSN 2470-0053

Yang, Huaiyu and Thati, Jyothi and Rasmuson, Åke C. (2012) Thermodynamics of molecular solids in organic solvents. Journal of Chemical Thermodynamics, 48. pp. 150-159. ISSN 0021-9614

van Lierop, Danny and Krpetic, Zeljka and Guerrini, Luca and Larmour, Iain A. and Dougan, Jennifer A. and Faulds, Karen and Graham, Duncan (2012) Positively charged silver nanoparticles and their effect on surface-enhanced Raman scattering of dye-labelled oligonucleotides. Chemical Communications, 48 (66). pp. 8192-8194. ISSN 1359-7345

2011

Ambury, R. F. and Merry, C. L. R. and Ulijn, R. V. (2011) Sugar functionalised PEGA surfaces support metabolically active hepatocytes. Journal of Materials Chemistry, 21. pp. 2901-2908. ISSN 0959-9428

Armstrong, David R. and Garcia-Alvarez, Pablo and Kennedy, Alan R. and Mulvey, Robert E. and Robertson, Stuart D. (2011) Molecular structures of THF-solvated alkali-metal 2,2,6,6-tetramethylpiperidides finally revealed: x-ray crystallographic, DFT, and NMR (including DOSY) spectroscopic studies. Chemistry - A European Journal, 17 (24). pp. 6725-6730. ISSN 1521-3765

Bailey, R. T. and Dines, T. J. and Tedford, M. C. (2011) Electron-phonon coupling in the molecular charge transfer crystal 2-(alpha-methylbenzylamino)-5-nitropyridine. Journal of Molecular Structure, 992 (1-3). pp. 52-58. ISSN 0022-2860

Baillie, Sharon E. and Clegg, William and Garcia-Alvarez, Pablo and Hevia, Eva and Kennedy, Alan R. and Klett, Jan and Russo, Luca (2011) Synthesis and characterization of an infinite sheet of metal-alkyl bonds : unfolding the elusive structure of an unsolvated alkali-metal trisalkylmagnesiate. Chemical Communications (London), 47 (1). pp. 388-390. ISSN 0009-241X

Balloch, Liam and Kennedy, Alan R. and Mulvey, Robert E. and Rantanen, Toni and Robertson, Stuart D. and Snieckus, Victor (2011) Concerning the structures of alkali-metal-mediated ortho zincation of benzamides and phenyl o-carbamate. Organometallics, 30 (1). pp. 145-152. ISSN 0276-7333

Barrett, Lee and Dougan, Jennifer A. and Faulds, Karen and Graham, Duncan (2011) Stable dye-labelled oligonucleotide-nanoparticle conjugates for nucleic acid detection. Nanoscale, 3 (8). pp. 3221-3227. ISSN 2040-3372

Bennie, Linsey S. and Fraser, Calum J. and Irvine, Stephanie and Kerr, William J. and Andersson, Shalini and Nilsson, Göran N. (2011) Highly active iridium(I) complexes for the selective hydrogenation of carbon-carbon multiple bonds. Chemical Communications (London), 47 (42). pp. 11653-11655. ISSN 0009-241X

Buchanan, Hilary A. S. and Meier-Augenstein, Wolfram and Daeid, Niamh Nic and Kerr, William (2011) Organic impurities, stable isotopes, or both : a comparison of instrumental and pattern recognition techniques for the profiling of 3,4-methylenedioxymethamphetamine. Analytical Methods, 3 (10). pp. 2279-2288. ISSN 1759-9660

Cabeza, Javier A. and Damonte, Marina and Garcia-Alvarez, Pablo and Kennedy, Alan and Perez-Carreno, Enrique (2011) Reactivity of [Ru-3(CO)(12)] with a phosphine-functionalized Imidazol-2-ylidene and Its imidazolium salt. Organometallics, 30 (4). pp. 826-833. ISSN 0276-7333

Chen, Yujie and Herrnsdorf, Johannes and Guilhabert, Benoit and Kanibolotsky, Alexander L. and Mackintosh, Allan R. and Wang, Yue and Pethrick, Richard A. and Gu, Erdan and Turnbull, Graham A. and Skabara, Peter J. and Samuel, Ifor D. W. and Laurand, Nicolas and Dawson, Martin D. (2011) Laser action in a surface-structured free-standing membrane based on a π-conjugated polymer-composite. Organic Electronics, 12 (1). pp. 62-69. ISSN 1566-1199

Clegg, William and Conway, Benjamin Grant and Kennedy, Alan R. and Klett, Jan and Mulvey, Robert E. and Russo, Luca (2011) Synthesis and structures of [(trimethylsilyl)methyl]sodium and -potassium with bi- and tridentate n-donor ligands. European Journal of Inorganic Chemistry, 2011 (5). pp. 721-726. ISSN 1434-1948

Cowley, Phillip M and Baker, James and Buchanan, Kirsteen I and Carlyle, Ian and Clark, John K and Clarkson, Thomas R and Deehan, Maureen and Edwards, Darren and Kiyoi, Yasuko and Martin, Iain and Osbourn, Dawn and Walker, Glenn and Ward, Nick and Wishart, Grant (2011) Pharmacokinetic optimisation of novel indole-2-carboxamide cannabinoid CB1 antagonists. Bioorganic and Medicinal Chemistry Letters, 21 (7). pp. 2034-2039. ISSN 0960-894X

Cussen, Edmund (2011) New compounds and structures in the solid state. Annual Reports on the Progress of Chemistry Section A: Inorganic Chemistry, 107. pp. 419-433. ISSN 0260-1818

Davidson, Matthew G. and Garcia-Vivo, Daniel and Kennedy, Alan R. and Mulvey, Robert E. and Robertson, Stuart D. (2011) Exploiting sigma/pi coordination isomerism to prepare homologous organoalkali metal (Li, Na, K) monomers with identical ligand sets. Chemistry - A European Journal, 17 (12). pp. 3364-3369. ISSN 1521-3765

Dennany, Lynn and Gerlach, Matthias and O'Carroll, Shane and Keyes, Tia E. and Forster, Robert J. and Bertoncello, Paolo (2011) Electrochemiluminescence (ECL) sensing properties of water soluble core-shell CdSe/ZnS quantum dots/Nafion composite films. Journal of Materials Chemistry, 21 (36). pp. 13984-13990. ISSN 0959-9428

Dougan, Jennifer A. and MacRae, Douglas and Graham, Duncan and Faulds, Karen (2011) DNA detection using enzymatic signal production and SERS. Chemical Communications (London), 47 (16). pp. 4649-4651. ISSN 0009-241X

Fartaria, Rui and Javid, Nadeem and Pethrick, Richard and Liggat, John and Sefcik, Jan and Sweatman, Martin (2011) Structure of laponite-styrene precursor dispersions for production of advanced polymer-clay nanocomposites. Soft Matter, 7 (19). pp. 9157-9166. ISSN 1744-6848

Farwick, Andreas and Engelhart, Jens and Tverskoy, Olena and Welter, Carolin and Umlauf, Quendolin and Rominger, Frank and Kerr, William and Helmchen, Gunter (2011) Bicyclic cyclopentenones via the combination of an iridium- catalyzed allylic substitution with a diastereoselective intramolecular Pauson–Khand reaction. Advanced Synthesis and Catalysis, 353 (2-3). pp. 349-370. ISSN 1615-4150

Fedorov, Maxim V. and Frolov, Andrey I. and Ratkova, Ekaterina L. and Palmer, David S. and Sergiievskyi, Volodymyr P. (2011) Efficient predictions of physchem properties of biomolecules in aqueous solutions using the Reference Interaction Site Model. Abstracts of papers - American Chemical Society, 242. ISSN 0065-7727

Fedorov, Maxim V. and Frolov, Andrey I. and Romanova, Anastasia O. and Kirchner, Kathleen and Terekhova, Irina V. (2011) Ion effects on biomolecule conformation and complex formation in water. Abstracts of papers - American Chemical Society, 241. -. ISSN 0065-7727

Frolov, Andrey I. and Rozhin, Alex G. and Fedorov, Maxim V. (2011) Ion interactions with the carbon nanotube surface in aqueous solutions. Abstracts of papers - American Chemical Society, 241. -. ISSN 0065-7727

Gibson, Kirsty F. and Correia-Ledo, Debby and Couture, Maxime and Graham, Duncan and Masson, Jean-Francois (2011) Correlated AFM and SERS imaging of the transition from nanotriangle to nanohole arrays. Chemical Communications (London), 47 (12). pp. 3404-3406. ISSN 0009-241X

Helen, W. and de Leonardis, P. and Ulijn, R. V. and Gough, J. and Tirelli, N. (2011) Mechanosensitive peptide gelation: mode of agitation controls mechanical properties and nano-scale morphology. Soft Matter, 7. pp. 1732-1740. ISSN 1744-6848

Hernandez-Santana, Aaron and Irvine, Eleanore and Faulds, Karen and Graham, Duncan (2011) Rapid prototyping of poly(dimethoxysiloxane) dot arrays by dip-pen nanolithography. Chemical Science, 2 (2). pp. 211-215. ISSN 2041-6539

Irvine, Eleanore Jane and Hernandez-Santana, Aaron and Faulds, Karen and Graham, Duncan (2011) Fabricating protein immunoassay arrays on nitrocellulose using Dip-pen lithography techniques. Analyst, 136 (14). pp. 2925-2930. ISSN 0003-2654

Jenkins, Matthew and Haw, Mark D. and Barker, Gary and Poon, Wilson and Egelhaaf, Stefan (2011) Finding bridges in packings of colloidal spheres. Soft Matter, 7 (2). pp. 684-690. ISSN 1744-6848

Kaziannis, Spyridon and Wright, Joseph A. and Candelaresi, Marco and Kania, Rafal and Greetham, Gregory M. and Parker, Anthony W. and Pickett, Christopher J. and Hunt, Neil T. (2011) The role of CN and CO ligands in the vibrational relaxation dynamics of model compounds of the [FeFe]-hydrogenase enzyme. Physical Chemistry Chemical Physics, 13 (21). pp. 10295-10305. ISSN 1463-9084

Kennedy, Alan R. and Morrison, Catriona A. and Briggs, Naomi E. B. and Arbuckle, William (2011) Density and stability differences between enantiopure and racemic salts : construction and structural analysis of a systematic series of crystalline salt forms of methylephedrine. Crystal Growth and Design, 11 (5). pp. 1821-1834. ISSN 1528-7483

Kiyoi, Takao and Adam, Julia M and Clark, John K and Davies, Keneth and Easson, Anna-Marie and Edwards, Darren and Feilden, Helen and Fields, Ruth and Francis, Stuart and Jeremiah, Fiona and McArthur, Duncan and Morrison, Angus J and Prosser, Alan and Ratcliffe, Paul D and Schulz, Jurgen and Wishart, Grant and Baker, James and Campbell, Robert and Cottney, Jean E and Deehan, Maureen and Epemolu, Ola and Evans, Louise (2011) Discovery of potent and orally bioavailable heterocycle-based cannabinoid CB1 receptor agonists. Bioorganic and Medicinal Chemistry Letters, 21 (6). pp. 1748-1753. ISSN 0960-894X

Kubiak-Ossowska, Karina and Mulheran, Paul A. (2011) Multiprotein interactions during surface adsorption : a molecular dynamics study of lysozyme aggregation at a charged solid surface. Journal of Physical Chemistry B, 115 (28). pp. 8891-8900. ISSN 1520-6106

Laing, Stacey and Hernandez-Santana, Aaron and Sassmannshausen, Joerg and Asquith, Darren L. and McInnes, Iain B. and Faulds, Karen and Graham, Duncan (2011) Quantitative detection of human tumor necrosis factor alpha by a resonance raman enzyme-linked immunosorbent assay. Analytical Chemistry, 83 (1). pp. 297-302. ISSN 0003-2700

MacIntyre, L. and Zheng, L. A. and Scullion, P. and Keating, P. and Watson, D. G. (2011) Metabolomic profiling of biomarkers of liver X receptor-induced toxicity in mouse liver tissue. Metabolomics, 7 (1). pp. 54-70. ISSN 1573-3882

Martino, Chiara and Zagnoni, Michele and Sandison, M E and Chanasakulniyom, Mayuree and Pitt, Andrew and Cooper, Jonathan (2011) Intracellular protein determination using droplet-based immunoassays. Analytical Chemistry, 83 (13). 5361–5368. ISSN 0003-2700

O'Reilly, Emmet J and Dennany, Lynn and Griffith, Darren and Moser, Francois and Keyes, Tia E and Forster, Robert J (2011) Ground and excited state communication within a ruthenium containing benzimidazole metallopolymer. Physical Chemistry Chemical Physics, 13 (15). pp. 7095-7101. ISSN 1463-9084

Peng, Zhangquan and Freunberger, Stefan A. and Hardwick, Laurence J. and Chen, Yuhui and Giordani, Vincent and Barde, Fanny and Novak, Petr and Graham, Duncan and Tarascon, Jean-Marie and Bruce, Peter G. (2011) Oxygen Reactions in a Non-Aqueous Li+ Electrolyte. Agewandte Chemie-International Edition, 50 (28). pp. 6351-6355. ISSN 1521-3773

Ratkova, Ekaterina L. and Sergiievskyi, Volodymyr P. and Chuev, Gennady N. and Fedorov, Maxim V. (2011) Reference interaction site model with structural descriptors correction as an efficient tool for hydration free energy predictions. Abstracts of papers - American Chemical Society, 241. -. ISSN 0065-7727

Rocks, Louise and Faulds, Karen and Graham, Duncan (2011) Rationally designed SERS active silica coated silver nanoparticles. Chemical Communications (London), 47 (15). pp. 4415-4417. ISSN 0009-241X

Saxl, Tania and Khan, Faaizah and Ferla, Matteo and Birch, David and Pickup, John (2011) A fluorescence lifetime-based fibre-optic glucose sensor using glucose/galactose-binding protein. Analyst, 136 (5). pp. 968-972. ISSN 0003-2654

Scanlon, Thomas and Brown, Richard and Reese, Jason and White, Craig and Ahmad, Abdul Ossman and Schuebler, Matthias (2011) Chemistry modelling in an open-source DSMC code. In: 4th European Conference for Aero-Space Sciences, EUCASS, 2011-07-04 - 2011-12-08.

Scanlon, Thomas and White, Craig and Schuebler, Matthias and Brown, Richard and Reese, Jason (2011) Thermochemistry modelling in an open-source DSMC code. In: 28th International Symposium on Shock Waves, 2011-07-17 - 2011-07-22.

Stevenson, Ross and Hueber, Axel J. and Hutton, Alan and McInnes, Iain B. and Graham, Duncan (2011) Nanoparticles and inflammation. ScientificWorld Journal, 11. pp. 1300-1312. ISSN 1537-744X

Stone, Nicholas and Kerssens, Marleen and Lloyd, Gavin Rhys and Faulds, Karen and Graham, Duncan and Matousek, Pavel (2011) Surface enhanced spatially offset Raman spectroscopic (SESORS) imaging - the next dimension. Chemical Science, 2 (4). pp. 776-780. ISSN 2041-6539

Sun, Shuqing and Thompson, David G. and Graham, Duncan and Leggett, Graham J. (2011) DNA nanofabrication by scanning near-field photolithography of oligo (ethylene glycol) terminated SAMs: Controlled scan-rate dependent switching between head group oxidation and tail group degradation. Journal of Materials Chemistry, 21 (37). pp. 14173-14177. ISSN 0959-9428

Thompson, David G. and McKenna, Ekaterina O. and Pitt, Andrew and Graham, Duncan (2011) Microscale mesoarrays created by dip-pen nanolithography for screening of protein-protein interactions. Biosensors and Bioelectronics, 26 (12). pp. 4667-4673. ISSN 0956-5663

Wright, Iain A. and Skabara, Peter J. and Forgie, John C. and Kanibolotsky, Alexander L. and González, Blanca and Coles, Simon J. and Gambino, Salvatore and Samuel, Ifor D. W. (2011) Electronic, redox and charge transport properties of an unusal hybrid structure : a bis(septithiophene) bridged by a fused tetrathiafulvalene (TTF). Journal of Materials Chemistry, 21 (5). pp. 1462-1469. ISSN 0959-9428

van Lierop, Danny and Faulds, Karen and Graham, Duncan (2011) Separation Free DNA Detection Using Surface Enhanced Raman Scattering. Analytical Chemistry, 83 (15). pp. 5817-5821. ISSN 0003-2700

van de Linde, Sebastian and Krstić, Ivan and Prisner, Thomas and Doose, Sören and Heilemann, Mike and Sauer, Markus (2011) Photoinduced formation of reversible dye radicals and their impact on super-resolution imaging. Photochemical and Photobiological Sciences, 10 (4). pp. 499-506. ISSN 1474-905X

2010

Afonina, I. and Skabara, P.J. and Vilela, F. and Kanibolotsky, A.L. and Forgie, J.C. and Bansal, Ashu K. and Turnbull, G. and Samuel, Ifor D. W. and Labram, John G. and Anthopoulos, T.D. and Coles, Simon J. and Hursthouse, M.B. (2010) Synthesis and characterisation of new diindenothienothiophene (DITT) based materials. Journal of Materials Chemistry, 20 (6). pp. 1112-1116.

Banneman, Marcus N. and Lue, Leo and Woodcock, Leslie V. (2010) Thermodynamic pressures for hard spheres and closed-virial equation-of-state. Journal of Chemical Physics, 132 (8). 084507. ISSN 0021-9606

Bannerman, Marcus N. and Lue, Leo (2010) Exact on-event expressions for discrete potential systems. Journal of Chemical Physics, 133 (12). 124506. ISSN 0021-9606

Barahona, Francisco and Turiel, Esther and Cormack, Peter A. G. and Martin-Esteban, Antonio. (2010) Chromatographic performance of molecularly imprinted polymers: Core-shell microspheres by precipitation polymerization and grafted MIP films via iniferter-modified silica beads. Journal of Polymer Science Part A: Polymer Chemistry, 48 (5). pp. 1058-1066. ISSN 0887-624X

Berlouis, L. and Morrow, J. (2010) Changes in hydrogen storage properties of carbon nano-horns submitted to thermal oxidation. International Journal of Hydrogen Energy, 35 (17). pp. 9070-9081. ISSN 0360-3199

Boughen, Louise and Liggat, John and Ellis, Graham (2010) Thermal degradation of polyethylene glycol 6000 and its effect on the assay of macroprolactin. Clinical Biochemistry, 43 (9). pp. 750-753. ISSN 0009-9120

Carbone, Paola and Lue, Leo (2010) Prediction of bulk density and molecular packing in model dendrimers with different chain stiffness. Macromolecules, 43 (21). pp. 9191-9197. ISSN 0024-9297

Castro, Isabel and Sherrington, David and Fortuny, Agusti and Fabregat, Azael and Stuber, Frank and Font, Josep and Bengoa, Christophe (2010) Synthesis of polymer-supported copper complexes and their evaluation in catalytic phenol oxidation. Catalysis Today, 157 (1-4). pp. 66-70.

Cianci, Michele and Tomaszewski, Bartlomiej and Helliwell, John R. and Halling, P.J. (2010) Crystallographic analysis of counterion effects on subtilisin enzymatic action in acetonitrile. Journal of the American Chemical Society, 132 (7). pp. 2293-2300. ISSN 1520-5126

Conway, Ben and Garcia-Alvarez, Pablo and Kennedy, Alan R. and Klett, Jan and Mulvey, Robert E. and Robertson, Stuart D. (2010) Structural insights into mono-amido tris-alkyl potassium aluminates. New Journal of Chemistry, 34 (8). pp. 1707-1712. ISSN 1144-0546

Curran, Judith M. and Chen, Rui and Stokes, Robert and Irvine, Eleanor and Graham, Duncan and Gubbins, Earl and Delaney, Deany and Amro, Nabil and Sanedrin, Raymond and Jamil, Haris and Hunt, John A. (2010) Nanoscale definition of substrate materials to direct human adult stem cells towards tissue specific populations. Journal of Materials Science: Materials in Medicine, 21 (3). pp. 1021-1029. ISSN 0957-4530

Curran, Judith M. and Stokes, Robert and Irvine, Eleanore and Graham, Duncan and Amro, N. A. and Sanedrin, R. G. and Jamil, H. and Hunt, John A. (2010) Introducing dip pen nanolithography as a tool for controlling stem cell behaviour: unlocking the potential of the next generation of smart materials in regenerative medicine. Lab on a Chip, 10 (13). pp. 1662-1670. ISSN 1473-0197

Cussen, E.J. and Cameron, William J. (2010) Persistence of the Jahn–Teller distortion of Mo5+ in double perovskites : a structural study of Ba2NdMoO6 and the effect of chemical doping in Ba2Nd1xYxMoO6. Journal of Materials Chemistry, 20 (7). pp. 1340-1347. ISSN 0959-9428

Cussen, Eddie and Collins, Oonagh Mary (2010) Magnetic dilution in magnetoresistive perovskites; cation doping in Ba2FeMoO6. In: RSC Solid State Group Christmas Meeting 2010, 2010-12-20 - 2010-12-21. (Unpublished)

Cussen, Edmund J. (2010) Structure and ionic conductivity in lithium garnets. Journal of Materials Chemistry, 20 (25). pp. 5167-5173. ISSN 0959-9428

Fontanals, Nuria and Marce, Rosa M. and Borrull, Francesc and Cormack, Peter A. G. (2010) Mixed-mode ion-exchange polymeric sorbents: dual-phase materials that improve selectivity and capacity. Trends in Analytical Chemistry, 29 (7). pp. 765-779. ISSN 0165-9936

Guilhabert, Benoit and Laurand, Nicolas and Herrnsdorf, Johannes and Chen, Yujie and Mackintosh, Allan R. and Kanibolotsky, Alexander L. and Gu, Erdan and Skabara, Peter J. and Pethrick, R. A. and Dawson, Martin D. (2010) Amplified spontaneous emission in free-standing membranes incorporating star-shaped monodisperse π-conjugated truxene oligomers. Journal of Optics, 12 (3). 035503. ISSN 0972-8821

Halling, P.J. and Gardossi, L. (2010) Guidelines for reporting of biocatalytic reactions. Trends in Biotechnology, 28 (4). pp. 171-180. ISSN 0167-7799

Harun, Norlida and Anderson, Robert A. and Cormack, Peter A. G. (2010) Analysis of ketamine and norketamine in hair samples using molecularly imprinted solid-phase extraction (MISPE) and liquid chromatography-tandem mass spectrometry (LC-MS/MS). Analytical and Bioanalytical Chemistry, 396 (7). pp. 2449-2459. ISSN 1618-2642

Hatlo, M.M. and Lue, L. (2010) Electrostatic interactions of charged bodies from the weak- to the strong-coupling regime. EPL: A Letters Journal Exploring the Frontiers of Physics, 89 (2). 25002. ISSN 0295-5075

Hatlo, Marius M. and Bohinc, Klemen and Lue, Leo (2010) The properties of dimers confined between two charged plates. Journal of Chemical Physics, 132 (11). p. 114102. ISSN 0021-9606

Haw, Mark D. (2010) Growth kinetics of colloidal chains and labyrinths. Physical Review E: Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics, 81 (3). 031402. ISSN 2470-0053

Kania, Rafal and Stewart, Andrew I. and Clark, Ian P. and Greetham, Gregory M. and Parker, Anthony W. and Towrie, Michael and Hunt, Neil T. (2010) Investigating the vibrational dynamics of a 17e(-) metallocarbonyl intermediate using ultrafast two dimensional infrared spectroscopy. Physical Chemistry Chemical Physics, 12 (5). pp. 1051-1063. ISSN 1463-9084

Kanibolotsky, Alexander L. and Perepichka, Igor F. and Skabara, Peter J. (2010) Star-shaped π-conjugated oligomers and their applications in organic electronics and photonics. Chemical Society Reviews, 39 (7). pp. 2695-2728. ISSN 0306-0012

Keenan, H.E. and Bangkedphol, S. and Sakultantimetha, A. and Songsasen, A. (2010) The ecological complexity of the Thai-Laos Mekong River : II. Metals and polyaromatic hydrocarbons (PAHs) monitoring, modelling and environmental fate. Journal of Environmental Science and Health Part A, 45 (13). pp. 1674-1680. ISSN 1093-4529

Kubiak-Ossowska, Karina and Mulheran, Paul A. (2010) Mechanism of hen egg white lysozyme adsorption on a charged solid surface. Langmuir, 26 (20). pp. 15954-15965. ISSN 0743-7463

Larmour, Iain A. and Faulds, Karen and Graham, Duncan (2010) Improved versatility of silver nanoparticle dimers for surface-enhanced raman spectroscopy. Journal of Physical Chemistry C, 114 (31). pp. 13249-13254.

Larmour, Iain A. and Faulds, Karen and Graham, Duncan (2010) The past and future of enzyme measurements using surface enhanced Raman spectroscopy. Chemical Science, 1 (2). pp. 151-160. ISSN 2041-6539

Lewicki, James P. and Pielichowski, Krzysztof and De la Croix, Pauline Tremblot and Janowski, Bartlomiej and Todd, Deborah and Liggat, John J. (2010) Thermal degradation studies of polyurethane/POSS nanohybrid elastomers. Polymer Degradation and Stability, 95 (6). pp. 1099-1105. ISSN 0141-3910

Liu, Hong-Ke and Parkinson, John and Bella, Juraj and Wang, Fuyi and Sadler, Peter (2010) Penetrative DNA intercalation and G-base selectivity of an organometallic tetrahydroanthracene RuII anticancer complex. Chemical Science, 1 (2). pp. 258-270. ISSN 2041-6539

Lue, L. and Bishop, Marvin and Whitlock, Paula A. (2010) The fluid to solid phase transition of hard hyperspheres in four and five dimensions. Journal of Chemical Physics, 132 (10). p. 104509. ISSN 0021-9606

McEntee, Greg J. and Skabara, Peter J. and Vilela, Filipe and Tierney, Steven and Samuel, Ifor D. W. and Gambino, Salvatore and Coles, Simon J. and Hursthouse, Michael B. and Harrington, Ross W. and Clegg, William (2010) Synthesis and electropolymerization of hexadecyl functionalized bithiophene and thieno[3,2-b]thiophene end-capped with EDOT and EDTT units. Journal of Materials Chemistry, 22 (9). pp. 3000-3008. ISSN 0959-9428

Mills, A. (2010) Water-based colourimetric optical indicators for the detection of carbon dioxide. Analyst, 135. pp. 1912-1917. ISSN 0003-2654

Mills, A. (2010) A comprehensive aerosol spray method for the rapid photocatalytic grid area analysis of semiconductor photocatalyst thin films. Analytica Chimica Acta, 663. pp. 69-76. ISSN 0003-2670

Mills, A. and Duckmanton, Paul and Reglinski, J. (2010) A simple, novel method for preparing an effective water oxidation catalyst. Chemical Communications (London), 46 (14). pp. 2397-2398. ISSN 0009-241X

Mills, A. and Hazafy, D. and Parkinson, J. and Tuttle, T. and Hutchings, Michael G. (2010) Effect of alkali on methylene blue (C.I. basic blue 9) and other thiazine dyes. Dyes and Pigments, 88 (2). pp. 149-155.

Mills, Andrew and Katafias, Anna and Chatłas, Janusz and Impert, Olga and Kita, Przemysław and Madej, Edyta and Topolskia, Adrian and Wrzeszcz, Grzegorz (2010) Reactivity difference between protolytic forms of some macrocyclic chromium(III) complexes in ligand substitution and electron transfer processes. Inorganica Chimica Acta, 363 (11). pp. 2346-2356. ISSN 0020-1693

Mills, Andrew and Skinner, Graham A. and Grosshans, Pauline (2010) Intelligent pigments and plastics for CO2 detection. Journal of Materials Chemistry, 20. pp. 5008-5010. ISSN 0959-9428

Mulheran, P. A. and Nolan, M. and Browne, C. S. and Basham, M. and Sanville, E. and Bennett, R. A. (2010) Surface and interstitial Ti diffusion at the rutile TiO2(110) surface. Physical Chemistry Chemical Physics, 12 (33). pp. 9763-9771. ISSN 1463-9084

Mulvey, R.E. and Naseri, Vasel and Less, R.J. and McPartlin, Mary and Wright, Dominic S. (2010) Stoichiometric and catalytic Sn-mediated dehydrocoupling of primary phosphines. Chemical Communications (London), 46 (27). pp. 5000-5002. ISSN 0009-241X

Murphy, John A. (2010) Physical organic chemistry. Beilstein Journal of Organic Chemistry, 6 (1025). p. 1025. ISSN 1860-5397

Paterson, Laura C and Kerr, William J and Sutherland, Andrew (2010) Towards the total synthesis of Agariblazeispirol C. Abstracts of papers - American Chemical Society, 240. ORGN-118.

Ritch, Jamie S. and Robertson, Stuart D. and Risto, Maarit and Chivers, Tristram (2010) Synthesis, multinuclear NMR spectra, and x-ray structures of (Bu2PNP)-Bu-t(I)Bu-t(2) and EPR2NP(I)R-2 (E = Se, Te; R = Pr-i, Bu-t). Inorganic Chemistry, 49 (10). pp. 4681-4686. ISSN 1520-510X

Stewart, Andrew I. and Wright, Joseph A. and Greetham, Gregory M. and Kaziannis, Spiridon and Santabarbara, Stefano and Towrie, Michael and Parker, Anthony W. and Pickett, Christopher J. and Hunt, Neil T. (2010) Determination of the photolysis products of [FeFe]hydrogenase enzyme model systems using ultrafast multidimensional infrared spectroscopy. Inorganic Chemistry, 49 (20). pp. 9563-9573. ISSN 1520-510X

Stone, Nicholas and Faulds, Karen and Graham, Duncan and Matousek, Pavel (2010) Prospects of deep raman spectroscopy for noninvasive detection of Conjugated Surface Enhanced Resonance Raman Scattering Nanoparticles Buried within 25 mm of Mammalian Tissue. Analytical Chemistry, 82 (10). pp. 3969-3973. ISSN 0003-2700

Sun, Shuqing and Thompson, David and Schmidt, Ute and Graham, Duncan and Leggett, Graham J. (2010) Micro-/nano-patterning of DNA and rapid readout with SERS tags. Chemical Communications (London), 46 (29). pp. 5292-5294. ISSN 0009-241X

Thompson, David G. and Faulds, Karen and Smith, W. Ewen and Graham, Duncan (2010) Precise control of the assembly of dye-coded oligonucleotide silver nanoparticle conjugates with single base mismatch discrimination using surface enhanced resonance raman scattering. Journal of Physical Chemistry C, 114 (16). pp. 7384-7389.

Wang, Yue and Tsiminis, Georgios and Yang, Ying and Ruseckas, Arvydas and Kanibolotsky, Alexander L. and Perepichka, Igor F. and Skabara, Peter and Turnbull, Graham A. and Samuel, Ifor D. W. (2010) Broadly tunable deep blue laser based on a star-shaped oligofluorene truxene. Synthetic Metals, 160 (13-14). pp. 1397-1400. ISSN 0379-6779

Wark, A.W. and McErlean, K. and Cruickshank, F.R. and Berlouis, L.E.A. and Brevet, P.F. (2010) Enhancement of the second harmonic signal from Hg1−xCdxTe (MCT) in the presence of an anodic oxide film. Journal of Electroanalytical Chemistry, 646 (1-2). pp. 133-141. ISSN 0022-0728

Yang, Z. and Halling, P.J. (2010) Hofmeister effects on activity and stability of alkaline phosphatase. BBA - Biomembranes, 1804 (4). pp. 821-828. ISSN 0005-2736

Yip, Thomas W.S. and Cussen, E.J. and MacLaren, Donald (2010) Synthesis of HxLi1-xLaTiO4 from quantitative solid-state reactions at room temperature. Chemical Communications (London), 46 (5). pp. 698-700. ISSN 0009-241X

Yip, Thomas W.S. and Cussen, Edmund J. and Wilson, Claire (2010) Spontaneous formation of crystalline lithium molybdate from solid reagents at room temperature. Dalton Transactions, 39 (2). pp. 411-417. ISSN 1472-7773

2009

Arbuckle, W. and Cartner, S. and Kennedy, A.R. and Morrison, C.A. (2009) Disodium (2rs, 3sr)-tartrate. Acta Crystallographica Section E: Structure Reports, 65. M1232-+. ISSN 1600-5368

Bannerman, M. N. and Magee, J. E. and Lue, L. (2009) Structure and stability of helices in square-well homopolymers. Physical Review E, 80 (2). ISSN 2470-0053

Bannerman, Marcus N. and Lue, Leo (2009) Transport properties of highly asymmetric hard-sphere mixtures. Journal of Chemical Physics, 130 (16). 164507. ISSN 0021-9606

Beltran, A. and Fontanals, N. and Marce, R.M. and Cormack, P.A.G. and Borrull, F. (2009) Molecularly imprinted solid-phase extraction of cephalexin from water-based matrices. Journal of Separation Science, 32 (19). pp. 3319-3326. ISSN 1615-9306

Berger, Jacob and Graham, Duncan (2009) CHED 309-Functionalized nanoparticles as new tools for bioanalysis. Abstracts of papers - American Chemical Society, 238. -. ISSN 0065-7727

Blair, V.L. and Clegg, W. and Mulvey, R.E. and Russo, L. (2009) Alkali-metal-mediated manganation(II) of naphthalenes: constructing metal la-anthracene and metalla-phenanthrene structures. Inorganic Chemistry, 48 (18). pp. 8863-8870. ISSN 1520-510X

Breen, D. and Kennedy, A.R. and Suckling, C.J. (2009) A divergent synthesis of minor groove binders with tail group variation. Organic and Biomolecular Chemistry, 7 (1). pp. 178-186. ISSN 1477-0520

Cerkovnik, J. and Plesnicar, B. and Koller, J. and Tuttle, T. (2009) Hydrotrioxides rather than cyclic tetraoxides (tetraoxolanes) as the primary reaction intermediates in the low-temperature ozonation of aldehydes. the case of benzaldehyde. Journal of Organic Chemistry, 74 (1). pp. 96-101. ISSN 0022-3263

Chisholm, M. and Sherrington, D.C. and Hudson, N.E. and Kirtley, N. and Vilela, F. (2009) Application of the "strathclyde route" to branched vinyl polymers in suspension polymerization: architectural, thermal, and rheological characterization of the derived branched products. Macromolecules, 42 (20). pp. 7745-7752. ISSN 0024-9297

Girvan, H.M. and Toogood, H.S. and Littleford, R.E. and Seward, H.E. and Smith, W.E. and Ekanem, I.S. and Leys, D. and Cheesman, M.R. (2009) Novel haem co-ordination variants of flavocytochrome P450 BM3. Biochemical Journal, 417. pp. 65-76. ISSN 0264-6021

Graham, D. and Faulds, Karen and Thompson, David and McKenzie, Fiona and Stokes, Robert J. and Dalton, Colette and Stevenson, Ross and Alexander, J. and Garside, Paul and McFarlane, Emma (2009) Functionalized nanoparticles for bioanalysis by SERRS. Biochemical Society Transactions, 37. pp. 697-701. ISSN 0300-5127

Halling, Peter J. (2009) Estimation of flattening coefficient for absorption and circular dichroism using simulation. Analytical Biochemistry, 387 (1). pp. 76-81. ISSN 0003-2697

Hatlo, Marius M. and Karatrantos, Argyrios and Lue, Leo (2009) One-component plasma of point charges and of charged rods. Physical Review E, 80 (6). ISSN 2470-0053

Hatlo, Marius M. and Lue, Leo (2009) A field theory for ions near charged surfaces valid from weak to strong couplings. Soft Matter, 5 (1). pp. 125-133. ISSN 1744-6848

Ingram, A.M. and Moore, B.D. and Graham, D. (2009) Simultaneous detection of alkaline phosphatase and beta-galactosidase activity using SERRS. Bioorganic and Medicinal Chemistry Letters, 19 (6). pp. 1569-1571. ISSN 0960-894X

Jayapal, P. and Mayer, G. and Heckel, A. and Wennmohs, F. (2009) Structure-Activity Relationships of a Caged Thrombin-Binding DNA Aptamer: Insight gained from molecular dynamics simulation studies. Journal of Structural Biology, 166 (3). pp. 241-250. ISSN 1047-8477

Koh, A.L. and Bao, K. and Khan, I. and Smith, W.E. and Kothleitner, G. and Nordlander, P. and Maier, S.A. and McComb, D.W. (2009) Electron energy-loss spectroscopy (EELS) of surface plasmons in single silver nanoparticles and dimers: influence of beam damage and mapping of dark modes. ACS Nano, 3 (10). pp. 3015-3022. ISSN 1936-0851

Kubiak, K. and Mulheran, P.A. (2009) Molecular dynamics simulations of hen egg white lysozyme adsorption at a charged solid surface. Journal of Physical Chemistry B, 113 (36). pp. 12189-12200.

Kuehne, A.J. and Elfstrom, D. and Mackintosh, A.R. and Kanibolotsky, Alexander and Guilhabert, Benoit Jack Eloi and Gu, E. and Perepichka, Igor F. and Skabara, P.J. and Dawson, M.D. and Pethrick, R.A. (2009) Fluorescent nanostructures : direct laser writing of nanosized oligofluorene truxenes in UV-transparent photoresist microstructures. Advanced Materials, 21 (7). pp. 781-785. ISSN 1521-4095

Kuehne, Alexander J. C. and Elfstrom, David and Mackintosh, Allan R. and Kanibolotsky, Alexander L. and Guilhabert, Benoit and Gu, Erdan and Perepichka, Igor F. and Skabara, Peter J. and Dawson, Martin D. and Pethrick, Richard A. (2009) Direct laser writing of nanosized oligofluorene truxenes in UV-transparent photoresist microstructures. Advanced Materials, 21 (7). 781–785. ISSN 0935-9648

Mills, A. and Grosshans, P. and Snadden, E. (2009) Hydrogen peroxide vapour indicator. Sensors and Actuators B: Chemical, 136 (2). pp. 458-463. ISSN 0925-4005

Mills, A. and Hazafy, D. (2009) Nanocrystalline sno2-based, uvb-activated, colourimetric oxygen indicator. Sensors and Actuators B: Chemical, 136 (2). pp. 344-349. ISSN 0925-4005

Mills, A. and Lawrie, K. and McFarlane, M. (2009) Blue bottle light: lecture demonstrations of homogeneous and heterogeneous photo-induced electron transfer reactions. Photochemical and Photobiological Sciences, 8 (3). pp. 421-425. ISSN 1474-905X

Mulheran, P.A. and Kubiak, K. (2009) Protein adsorption mechanisms on solid surfaces: lysozyme-on-mica. Molecular Simulation, 35 (7). pp. 561-566. ISSN 1029-0435

Sanville, E. J. and Vernon, L. J. and Kenny, S. D. and Smith, R. and Moghaddam, Y. and Browne, C. and Mulheran, P. (2009) Surface and interstitial transition barriers in rutile (110) surface growth. Physical Review B, 80 (23). 235308. ISSN 1098-0121

Sassmannshausen, J. (2009) Dft investigation of the 'quasi-living' propene polymerisation with Cp*TiMe3/b(C6F5)(3): the 'naked cation' approach. Dalton Transactions (41). pp. 8993-8999. ISSN 1472-7773

Sassmannshausen, J. and Baumgartner, J. (2009) Synthesis and reactivity of trimethylsilyl substituted mono(cyclopentadienyl)titanium alkyl complexes. Kinetics and Catalysis, 50 (5). pp. 676-683. ISSN 0023-1584

Soos, Miroslav and Lattuada, Marco and Sefcik, Jan (2009) Interpretation of light scattering and turbidity measurements in aggregated systems: effect of intra-cluster multiple-light scattering. Journal of Physical Chemistry B, 113 (45). pp. 14962-14970. ISSN 1520-6106

Tang, L.P. and Diamond, L. and Macdonald, M. and McMillan, B.G. and Morrow, J. and Spicer, M.D. and Berlouis, L.E.A. and Weston, M. (2009) Impact of synthesis temperature on hydrogen storage and emission from Ni/Ce composite oxides. International Journal of Hydrogen Energy, 34 (17). pp. 7296-7305. ISSN 0360-3199

Tuttle, T. (2009) Averaging semiempirical NMR chemical shifts: dynamic effects on the subpicosecond time scale. Journal of Physical Chemistry A, 113 (43). pp. 11723-11733. ISSN 1089-5639

Yaffe, Nicola R. and Ingram, Andrew and Graham, Duncan and Blanch, Ewan W. (2009) A multi-component optimisation of experimental parameters for maximising SERS enhancements. Journal of Raman Spectroscopy, 41 (6). pp. 618-623. ISSN 0377-0486

Zhang, Yonghao and Ozdemir, Pinar (2009) Microfluidic DNA amplification - a review. Analytica Chimica Acta, 638 (2). pp. 115-125. ISSN 0003-2670

2008

Armstrong, D.R. and Dougan, C. and Graham, D.V. and Hevia, E. and Kennedy, A.R. (2008) Synthesis and structural elucidation of alkyl, amido, and mixed. alkyl-amido "highly-coordinated" zincates. Organometallics, 27 (23). pp. 6063-6070. ISSN 0276-7333

Armstrong, D.R. and Drummond, A.M. and Balloch, L. and Graham, D.V. and Hevia, E. and Kennedy, A.R. (2008) Metalation of 2,4,6-trimethylacetophenone using organozinc reagents: the role of the base in determining composition and structure of the developing enolate. Organometallics, 27 (22). pp. 5860-5866. ISSN 0276-7333

Armstrong, D.R. and Graham, D.V. and Kennedy, A.R. and Mulvey, R.E. and O'Hara, C.T. (2008) A structural and computational study of synthetically important alkali-metal/tetramethylpiperidide (tmp) amine solvates. Chemistry - A European Journal, 14 (26). pp. 8025-8034. ISSN 1521-3765

Beltran, Antoni and Marce, Rosa M. and Cormack, Peter A. G. and Sherrington, David C. and Borrull, Francesc (2008) Selective solid-phase extraction of amoxicillin and cephalexin from urine samples using a molecularly imprinted polymer. Journal of Separation Science, 31 (15). pp. 2868-2874. ISSN 1615-9306

Besenius, P. and Slavin, S. and Vilela, F. and Sherrington, D.C. (2008) Synthesis and characterization of water-soluble densely branched glycopolymers. Reactive and Functional Polymers, 68 (11). pp. 1524-1533. ISSN 1381-5148

Chan, W.T.K. and Eisler, D. and Garcia, F. and Gonzalez-Calera, S. and McPartlin, M. and Morey, J.V. and Mulvey, R.E. and Singh, S. (2008) Synthesis and structure of the li-13 cage [{[o - p(mu-(nbu)-bu-t)](2)li-2}(3)(licl)(6)li(cl/(obu)-bu-n)(0.5)(thf)(7)], containing a [o - p(mu-(nbu)-bu-t)](2)(2-) dianion. Chemical Communications (London) (19). pp. 2251-2253. ISSN 0009-241X

Clegg, W. and Davidson, M.G. and Graham, D.V. and Griffen, G. and Jones, M.D. and Kennedy, A.R. and O'Hara, C.T. and Russo, L. (2008) Synthetic and structural investigations of alkali metal diamine bis(phenolate) complexes. Dalton Transactions (10). pp. 1295-1301. ISSN 1472-7773

Clegg, W. and Garcia-Alvarez, J. and Garcia-Alvarez, P. and Graham, D.V. and Harrington, R.W. and Hevia, E. and Kennedy, A.R. and Mulvey, R.E. (2008) Synthesis, structural authentication, and structurally defined metalation reactions of lithium and sodium da-zincate bases (da = diisopropylamide) with phenylacetylene. Organometallics, 27 (11). pp. 2654-2663. ISSN 0276-7333

Conway, B. and Graham, D.V. and Hevia, E. and Kennedy, A.R. and Klett, J. and Mulvey, R.E. (2008) Structurally-defined potassium-mediated regioselective zincation of amino-and alkoxy-substituted pyridines. Chemical Communications (London) (23). pp. 2638-2640. ISSN 0009-241X

Cormack, P.A.G. and Hernandez-Santana, A. and Prasath, R.A. and McKenzie, F. and Graham, D. and Smith, W.E. (2008) Multidentate macromolecules for functionalisation, passivation and labelling of metal nanoparticles. Chemical Communications (London) (22). pp. 2517-2519. ISSN 0009-241X

Crouch, D.J. and Skabara, P.J. and Heeney, M. and McCulloch, I. and Sparrowe, D. and Coles, S.J. and Hursthouse, M.B. (2008) Hexyl-Substituted Oligoselenophenes with central Tetrafluorophenylene units: synthesis, characterisation and application in organic field effect transistors. Macromolecular Rapid Communications, 29 (22). pp. 1839-1843. ISSN 1022-1336

Deere, J. and De Oliveira, R.F. and Tomaszewski, B. and Millar, S. and Lalaouni, A. and Solares, Laura F. and Flitsch, Sabine L. and Halling, P.J. (2008) Kinetics of enzyme attack on substrates covalently attached to solid surfaces : influence of spacer chain length, immobilised substrate surface concentration and surface charge. Langmuir, 24 (20). pp. 11762-11769. ISSN 0743-7463

Douglas, P. and Stokes, R.J. and Graham, D. and Smith, W.E. (2008) Immunoassay for P38 MAPK using surface enhanced resonance Raman spectroscopy (SERRS). Analyst, 133 (6). pp. 791-796. ISSN 0003-2654

Fak, Bjorn and Coomer, Fiona and Harrison, Andrew and Visser, Dirk and Zhitomirsky, M E (2008) Spin-liquid behavior in a kagome antiferromagnet : Deuteronium jarosite. EPL: A Letters Journal Exploring the Frontiers of Physics, 81 (1). 17006. ISSN 0295-5075

Faulds, K. and Jarvis, R. and Smith, W.E. and Graham, D. and Goodacre, R. (2008) Multiplexed detection of six labelled oligonucleotides using surface enhanced resonance Raman scattering (SERRS). Analyst, 133 (11). pp. 1505-1512. ISSN 0003-2654

Fontanals, N. and Cormack, P.A.G. and Sherrington, D.C. (2008) Hypercrosslinked polymer microspheres with weak anion-exchange character : preparation of the microspheres and their applications in pH-tuneable, selective extractions of analytes from complex environmental samples. Journal of Chromatography A, 1215 (1-2). pp. 21-29. ISSN 0021-9673

Fraser, Isla and Meier-Augenstein, Wolfram and Kalin, Robert M. (2008) Stable isotope analysis of human hair and nail samples: the effects of storage on samples. Journal of Forensic Sciences, 53 (1). pp. 95-99.

Garcia-Alvarez, P. and Graham, D.V. and Hevia, E. and Kennedy, A.R. and Klett, J. and Mulvey, R.E. and O'Hara, C.T. and Weatherstone, Susan (2008) Unmasking representative structures of tmp-active hauser and turbo-hauser bases. Angewandte Chemie, 47 (42). pp. 8079-8081. ISSN 1521-3773

Gibson, L.T. and Kerr, W.J. and Nordon, A. and Reglinski, J. and Robertson, C. and Turnbull, L. and Watt, C.M. and Cheung, A. and Johnstone, W. (2008) On-site determination of formaldehyde : a low cost measurement device for museum environments. Analytica Chimica Acta, 623 (1). pp. 109-116. ISSN 0003-2670

Graham, D. and Thompson, D.G. and Smith, W.E. and Faulds, K. (2008) Control of enhanced raman scattering using a DNA-based assembly process of dye-coded nanoparticles. Nature Nanotechnology, 3 (9). pp. 548-551. ISSN 1748-3387

Halling, P.J.; Carrea, Giacomo and Riva, Sergio, eds. (2008) Biocatalysis with undissolved solid substrates and products. In: Organic Synthesis with Enzymes in Non-Aqueous Media. Wiley-VCH, pp. 279-287. ISBN 9783527318469

Hatlo, Marius M. and Curtis, R.A. and Lue, Leo (2008) Electrostatic depletion forces between planar surfaces. Journal of Chemical Physics, 128 (16). 164717. ISSN 0021-9606

Hatlo, Marius M. and Lue, Leo (2008) The role of image charges in the interactions between colloidal particles. Soft Matter, 4 (8). pp. 1582-1596. ISSN 1744-6848

Ingram, S.E. and Pethrick, R.A. and Liggat, J.J. (2008) Effects of organically modified clay loading on rate and extent of cure in an epoxy nanocomposite system. Polymer International, 57 (11). pp. 1206-1214.

Kerouredan, E. and Percy, J.M. and Rinaudo, G. and Singh, K. (2008) A concise route to difluorinated analogues of cyclitols and sugars. Synthesis (24). pp. 3903-3918. ISSN 0039-7881

Lewicki, J.P. and Patel, M. and Morrell, P. and Liggat, J.J. and Murphy, J. and Pethrick, R.A. (2008) The stability of polysiloxanes incorporating nano-scale physical property modifiers. Science and Technology of Advanced Materials, 9 (2). 024403-024411. ISSN 1468-6996

Lundhal, P. and Stokes, R. and Smith, E.W. and Martin, R. and Graham, D. (2008) Synthesis and characterisation of monodispersed silver nanoparticles with controlled size ranges. Micro and Nano Letters, 3 (2). pp. 62-65. ISSN 1750-0443

Magee, James E. and Lue, Leo and Curtis, Robin A. (2008) Density of states for a short overlapping-bead polymer: Clues to a mechanism for helix formation? Physical Review E, 78 (3). 031803. ISSN 2470-0053

McAdam, C.P. and Hudson, N.E. and Liggat, J.J. and Pethrick, R.A., EPSRC (Funder) (2008) Synthesis and characterization of nylon 6/clay nanocomposites prepared by ultrasonication and in situ polymerization. Journal of Applied Polymer Science, 108 (4). pp. 2242-2251. ISSN 0021-8995

McKenzie, Fiona and Faulds, Karen and Graham, Duncan (2008) LNA functionalized gold nanoparticles as probes for double stranded DNA through triplex formation. Chemical Communications (London) (20). pp. 2367-2369. ISSN 0009-241X

Mills, Andrew and Crow, Matthew (2008) A study of factors that change the wettability of titania films. International Journal of Photoenergy. 470670. ISSN 1110-662X

Mills, Andrew and McGrady, Mark and Wang, Jishun and Hepburn, James (2008) A rapid method of assessing the photocatalytic activity of thin TiO2 films using an ink based on the redox dye 2,6-dichloroindophenol. International Journal of Photoenergy, 2008. 504945. ISSN 1110-662X

Mills, Andrew and Tommons, Cheryl and Bailey, Raymond T. and Tedford, M. Catriona and Crilly, Peter J. (2008) UV-activated luminescence/colourimetric O2 indicator. International Journal of Photoenergy. 547301. ISSN 1110-662X

Mulheran, P.A. and Pellenc, D. and Bennett, R.A. and Green, R.J. and Sperrin, M. (2008) Mechanisms and dynamics of protein clustering on a solid surface. Physical Review Letters, 100 (6). 068102. ISSN 1079-7114

Notman, N. and Graham, D. (2008) People power. Journal of Analytical Atomic Spectrometry, 23 (6). T45-T45. ISSN 0267-9477

Pascoe, Cherilyn and Graham, Duncan (2008) CHED 146-Functionalized nanoparticles as responsive nanobiosensors. Abstracts of papers - American Chemical Society, 236. -. ISSN 0065-7727

Pellenc, D. and Bennett, R.A. and Green, R.J. and Sperrin, M. and Mulheran, P.A. (2008) New insights on growth mechanisms of protein clusters at surfaces : an AFM and simulation study. Langmuir, 24 (17). pp. 9648-9655. ISSN 0743-7463

Steven, V. and Graham, D. (2008) Oligonucleotide conjugation to a cell-penetrating (tat) peptide by diels-alder cycloaddition. Organic and Biomolecular Chemistry, 6 (20). pp. 3781-3787. ISSN 1477-0520

Stewart, A. Ian and Towrie, M. and Clark, Ian P. and Parker, Anthony W. and Ibrahim, Saad and Pickett, Chris J. and Hunt, Neil T. (2008) PHYS 329-Applications of ultrafast 2-D infrared spectroscopy to studies of the Fe-hydrogenase enzyme system. Abstracts of papers - American Chemical Society, 235. -. ISSN 0065-7727

Stokes, R.J. and Dougan, J.A. and Graham, D. (2008) Dip-pen nanolithography and serrs as synergic techniques. Chemical Communications (London) (44). pp. 5734-5736. ISSN 0009-241X

Stokes, Robert J. and Ingram, Andrew and Gallagher, Jane and Armstrong, David R. and Smith, W. Ewen and Graham, Duncan (2008) Squaraines as unique reporters for SERRS multiplexing. Chemical Communications (London) (5). pp. 567-569. ISSN 0009-241X

Thompson, D.G. and Enright, A. and Faulds, K. and Smith, W.E. and Graham, D. (2008) Ultrasensitive DNA detection using oligonucleotide-silver nanoparticle conjugates. Analytical Chemistry, 80 (8). pp. 2805-2810. ISSN 0003-2700

Thompson, D.G. and Stokes, R.J. and Martin, R.W. and Lundahl, R.J. and Faulds, K. and Graham, D. (2008) Synthesis of unique nanostructures with novel optical properties using oligonucleotide mixed-metal nanoparticle conjugates. Small, 4 (8). pp. 1054-1057. ISSN 1613-6810

2007

Coomer, Fiona and Bondah-Jagalu, V and Harrison, Andrew and McIntyre, G J and Ronnow, H M and Feyerherm, R and Wand, T and Meissner, M and McMorrow, D F (2007) Neutron diffraction studies of nuclear and magnetic structures in the S=1∕2 square Heisenberg antiferromagnets (d6-5CAP)2CuX4 (X=Br and Cl). Physical Review B: Condensed Matter and Materials Physics, 75 (9). 094424. ISSN 1098-0121

Cormack, Peter (2007) The science behind repeating units. Materials Today, 10 (6). p. 53. ISSN 1369-7021

Magee, James E. and Song, Zhankai and Curtis, Robin A. and Lue, L. (2007) Structure and aggregation of a helix-forming polymer. Journal of Chemical Physics, 126 (14). 144911. ISSN 0021-9606

Mulvey, R.E. and Garcia-Alvarez, J. and Kennedy, A.R. and Klett, J. (2007) Alkali-metal-mediated manganation: a method for directly attaching manganese(II) centers to aromatic frameworks. Angewandte Chemie, 46 (7). pp. 1105-1108. ISSN 1521-3773

Mulvey, R.E. and Kennedy, A.R. and Hevia, E. (2007) Structurally-defined direct C-magnesiation and C-zincation of N-heterocyclic aromatic compounds using alkali-metal-mediated metallation. Chemical Communications (London) (27). pp. 2864-2866. ISSN 0009-241X

Mulvey, R.E. and Kennedy, A.R. and Klett, J. and Hevia, E. and Garcia Alvarez, Joaquin (2007) Lewis base stabilized lithium TMP-aluminates: an unexpected fragmentation and capture reaction involving cyclic ether 1,4-dioxane. Chemical Communications (London) (23). pp. 2402-2404. ISSN 0009-241X

Mulvey, R.E. and Mongin, F. and Uchiyama, M. and Kondo, Y. (2007) Deprotonative metalation using ate compounds: synergy, synthesis, and structure building. Angewandte Chemie, 46 (21). pp. 3802-3824. ISSN 1521-3773

Pang, Hao and Vilela, Filipe and Skabara, Peter and McDouall, Joseph J. W. and Crouch, David J. and Anthopoulos, Thomas D. and Bradley, Donal D. C. and De Leeuw, Dago M. and Horton, Peter N. and Hursthouse, Michael B. (2007) Advantageous 3-D ordering of pi-conjugated systems : a new approach towards efficient charge transport in any direction. Advanced Materials, 19 (24). pp. 4438-4442. ISSN 1521-4095

Robertson, Stuart D. and Chivers, Tristram and Konu, Jari (2007) Organo-aluminum, zinc and magnesium derivatives of the imidotris(amido)phosphate Me3SiNP((NHBu)-Bu-t)(3). Journal of Organometallic Chemistry, 692 (20). pp. 4327-4336. ISSN 0022-328X

Robertson, Stuart D. and Slawin, Alexandra M. Z. and Woollins, J. Derek (2007) Constructing multimetallic systems with the naphthalene-1,8-bis(thiolato) ligand. European Journal of Inorganic Chemistry (2). pp. 247-253. ISSN 1434-1948

2006

Baillie, S.H. and Hevia, E. and Kennedy, A.R. and Mulvey, R.E. (2006) Synthesis of mixed alkali-metal-zinc enolate complexes derived from 2,4,6-trimethylacetophenone: new inverse crown structures. Organometallics, 26 (1). pp. 204-209. ISSN 0276-7333

Lagerwall, Jan P.F. and Giesseimann, Frank and Osipov, Mikhail (2006) On the change in helix handedness at transitions between the SmC* and phases in chiral smectic liquid crystals. Liquid Crystals, 33 (6). pp. 625-633. ISSN 0267-8292

Lue, L. (2006) A variational field theory for solutions of charged, rigid particles. Fluid Phase Equilibria, 241 (1-2). pp. 236-247. ISSN 0378-3812

Lue, L. and Bishop, Marvin (2006) Molecular dynamics study of the thermodynamics and transport coefficients of hard hyperspheres in six and seven dimensions. Physical Review E, 74 (2). 021201. ISSN 2470-0053

Magee, James E. and Vasquez, Victor R. and Lue, Leo (2006) Helical structures from an isotropic homopolymer model. Physical Review Letters, 96. p. 207802. ISSN 1079-7114

Mirzaeian, M. and Hall, P.J.; (2006) Carbon dioxide sequestration in coal : implications for co2 disposal and ch4 displacement from coal seams. In: Geo-Environment and Landscape Evolution II. WIT Press, pp. 151-160. ISBN 1-84564-168-X

Saipa, Alexander and Osipov, Mikhail and Lanham, Kenneth W. and Chang, Catherine H. and Walba, David M. and Giesselmann, Frank (2006) The intrinsic photorefractive effect in the smectic C* phase of a chiral azobenzene. Journal of Materials Chemistry, 16. pp. 4170-4177.

2005

Curtis, R.A. and Lue, L. (2005) Electrolytes at spherical dielectric interfaces. Journal of Chemical Physics, 123 (17). ISSN 0021-9606

Kosmidis, C. and Siozos, P. and Kaziannis, S. and Robson, L. and Ledingham, K.W.D. and McKenna, P. and Jaroszynski, D.A. (2005) Interaction mechanism of some alkyl iodides with femtosecond laser pulses. Journal of Physical Chemistry A, 109 (7). pp. 1279-1285. ISSN 1089-5639

Lue, L. (2005) Collision statistics, thermodynamics, and transport coefficients of hard hyperspheres in three, four, and five dimensions. Journal of Chemical Physics, 122. 044513. ISSN 0021-9606

Sweatman, M.B. and Quirke, N.; Quirke, N., ed. (2005) Modelling gas adsorption in slit-pores using Monte-Carlo simulation. In: Adsorption and Transport at the Nanoscale. CRC/Taylor & Francis Group, pp. 15-41. ISBN 0-415-32701-6

2004

Aucott, S M and Milton, H L and Robertson, S D and Slawin, A M Z and Walker, G D and Woollins, J D (2004) Platinum complexes of naphthalene-1,8-dichalcogen and related polyaromatic hydrocarbon ligands. Chemistry - A European Journal, 10 (7). pp. 1666-1676. ISSN 1521-3765

Magee, James E. and Warwicker, J. and Lue, L. (2004) Freezing and folding behavior in simple off-lattice heteropolymers. Journal of Chemical Physics, 120 (23). pp. 11285-11291. ISSN 0021-9606

Striolo, Alberto and Colina, Coray M. and Gubbins, Keith E. and Elvassore, Nicola and Lue, L. (2004) The depletion attraction between pairs of colloid particles in polymer solution. Molecular Simulation, 30 (7). pp. 437-449. ISSN 1029-0435

2003

Linacre, A.M.T. (2003) The UK national DNA database. Lancet, 361 (9372). pp. 1841-1842. ISSN 0140-6736

2002

Barriau, E. and Cormack, P.A.G. and Daly, J.H. and Liggat, J.J. and Quincy, A. (2002) Synthesis and characterisation of an extended series of biodegradable cycloaliphatic polyesters. European Cells and Materials, 4 (Suppl.). p. 100. ISSN 1473-2262

Daeid, N N and Thain, E (2002) Measurement of temperature rise over time for commercially available night lights (tea lights). Fire Safety Journal, 37 (3). pp. 329-336. ISSN 0379-7112

Haddrill, P. R. and Majerus, M. E N and Mayes, S. (2002) Isolation and characterization of highly polymorphic microsatellite loci in the 2-spot ladybird, Adalia bipunctata. Molecular Ecology Notes, 2 (3). pp. 316-319. ISSN 1471-8278

Kiselev, S.B. and Ely, J.F. and Lue, L. and Elliott, J.R. (2002) Computer simulations and crossover equation of state of square-well fluids. Fluid Phase Equilibria, 200 (1). pp. 121-145. ISSN 0378-3812

Lue, L. and Jepps, O. G. and Delhommelle, J. and Evans, D. J. (2002) Configurational thermostats for molecular systems. Molecular Physics, 100 (14). pp. 2387-2395.

Lue, Leo and Kiselev, Sergei B. (2002) Crossover behavior of linear and star polymers in good solvents. International Journal of Thermophysics, 23 (1). pp. 117-134.

Lue, Leo and Woodcock, Leslie V. (2002) Depletion and ''fines'' effects on transport in hard-sphere colloids. International Journal of Thermophysics, 23 (4). pp. 937-947.

Triftaridou, Aggeliki I. and Vamvakaki, Maria and Patrickios, Costas S. and Lue, L. (2002) Synthesis, characterization, and modeling of ABC triblock terpolymers: the effect of block sequence. Macromolecular Symposia, 183 (1). pp. 133-138. ISSN 1022-1360

Waddell, R J H and Littlejohn, D and Nic Daeid, Niamh (2002) Organic and inorganic impurity profiling in illicit ecstasy seizures with the application of principle component analysis. Abstracts of papers - American Chemical Society, 224. U122-U123. ISSN 0065-7727

2001

Jensen, S.B. and Spicer, M.D. (2001) (eta(6)-Benzene)dichloro(diallylphenylphosphine)ruthenium(II), the first structurally characterized complex with the diallylphosphine ligand. Acta Crystallographica Section E: Structure Reports, 57 (10). o978-o979. ISSN 1600-5368

Lue, L. and Kiselev, S. B. (2001) Crossover behavior of star polymers in good solvents. Journal of Chemical Physics, 114 (11). pp. 5026-5033. ISSN 0021-9606

2000

Jiang, D.D. and Levchik, G.F. and Levchik, S.V. and Dick, C. and Liggat, J.J. and Snape, Colin and Wilkie, C.A. (2000) Thermal degradation of cross-linked polyisoprene and polychloroprene. Polymer Degradation and Stability, 68 (1). pp. 75-82. ISSN 0141-3910

Lue, L. (2000) Equation of state for polymer chains in good solvents. Journal of Chemical Physics, 112 (7). pp. 3442-3449. ISSN 0021-9606

Lue, L. (2000) Volumetric behavior of athermal dendritic polymers: Monte Carlo simulation. Macromolecules, 33 (6). pp. 2266-2272. ISSN 0024-9297

Lue, L. and Evans, D. J. (2000) Configurational temperature for systems with constraints. Physical Review E: Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics, 62 (4). pp. 4764-4768. ISSN 2470-0053

Lue, L. and Friend, D.G. and Elliott, J.R. (2000) Critical compressibility factors for chain molecules. Molecular Physics, 98 (18). pp. 1473-1477. ISSN 0026-8976

Patrickios, C. S. and Lue, L. (2000) Equation of state for star polymers in good solvents. Journal of Chemical Physics, 113 (13). pp. 5485-5492. ISSN 0021-9606

Postlethwaite, B. and Edgar, C. (2000) A MIMO fuzzy model-based controller. Chemical Engineering Research and Design, 78 (4). pp. 557-564. ISSN 0263-8762

1999

Fornasiero, F. and Lue, L. and Bertucco, A. (1999) Improving cubic EOSs near the critical point by a phase-space cell approximation. AIChE Journal, 45 (4). pp. 906-915. ISSN 0001-1541

Lue, L. and Kiselev, S. B. (1999) Crossover approach to scaling behavior in dilute polymer solutions: theory and simulation. Journal of Chemical Physics, 110 (5). pp. 2684-2691. ISSN 0021-9606

Lue, L. and Kiselev, S.B. (1999) Crossover behavior in dilute polymer solutions: Square-well chains. Journal of Chemical Physics, 111 (12). pp. 5580-5592. ISSN 0021-9606

Lue, L. and Woodcock, L. V. (1999) Depletion effects and gelation in a binary hard-sphere fluid. Molecular Physics, 96 (9). pp. 1435-1443. ISSN 0026-8976

Lue, L. and Zoeller, N. and Blankschtein, D. (1999) Incorporation of nonelectrostatic interactions in the Poisson- Boltzmann equation. Langmuir, 15 (11). pp. 3726-3730.

1998

Daeid, N N and Lynch, J and Wideman, D A (1998) Statistical differences between offender groups. Forensic Science International, 98 (3). pp. 151-156. ISSN 0379-0738

Lue, L. (1998) An analytic formula for the excluded volume between a sphere and a freely jointed chain. Journal of Colloid and Interface Science, 202 (2). pp. 558-561. ISSN 0021-9797

Lue, L. and Prausnitz, J. M. (1998) Renormalization-group corrections to an approximate free-energy model for simple fluids near to and far from the critical region. Journal of Chemical Physics, 108 (13). pp. 5529-5536. ISSN 0021-9606

Lue, L. and Prausnitz, J. M. (1998) Thermodynamics of fluid mixtures near to and far from the critical region. AIChE Journal, 44 (6). pp. 1455-1466. ISSN 0001-1541

1997

Daeid, N N (1997) Differences in offender profiling in the United States of America and the United Kingdom. Forensic Science International, 90 (1-2). pp. 25-31. ISSN 0379-0738

Daeid, N N (1997) Suicide in Ireland - 1982 to 1992. Archives of Suicide Research, 3 (1). pp. 31-42. ISSN 1381-1118

Hall, P.J. (1997) Einstein specific heat modeling of the effects of chlorobenzene refluxing on the macromolecular structure of Pittsburgh No. 8 coal. Energy and Fuels, 11 (5). pp. 1003-1005. ISSN 0887-0624

Lue, L. and Prausnitz, J. M. (1997) Structure and thermodynamics of homogeneous-dendritic-polymer solutions: Computer simulation, integral-equation, and lattice-cluster theory. Macromolecules, 30 (21). pp. 6650-6657.

Zoeller, N. and Lue, L. and Blankschtein, D. (1997) Statistical-thermodynamic framework to model nonionic micellar solutions. Langmuir, 13 (20). pp. 5258-5275.

1996

Craig, F J and Kennedy, A R and Mulvey, R E and Spicer, M D (1996) Structures of the potassium aluminates [{K-2(Me(3)AlOBu(t))(2)center dot pmdeta}(infinity)] and [{K(pmdeta)(2)}(+)(AlMe(4))(-)]: how the nature of the alane reagent determines which of these products form from alkoxide-containing reaction mixtures. Chemical Communications (London) (16). pp. 1951-1952. ISSN 0009-241X

Liggat, J.J. (1996) Editorial - PHB and hydroxyalkanoate polymers. Polymer International, 39 (3). p. 167.

Lue, L. and Blankschtein, D. (1996) A liquid-state theory approach to modeling solute partitioning in phase-separated solutions. Industrial and Engineering Chemistry Research, 35 (9). pp. 3032-3043. ISSN 0888-5885

1995

Lue, L. and Blankschtein, D. (1995) Analytical solution of the proper integral-equations for interaction site fluids. Journal of Chemical Physics, 103 (3). pp. 1229-1231. ISSN 0021-9606

Lue, L. and Blankschtein, D. (1995) Analytical solutions of the proper integral-equations for interaction site fluids: molecules composed of hard-sphere interaction sites. Journal of Chemical Physics, 103 (16). pp. 7086-7097. ISSN 0021-9606

Lue, L. and Blankschtein, D. (1995) Application of integral equation theories to predict the structure of diatomic fluids. Journal of Chemical Physics, 102 (10). pp. 4203-4216. ISSN 0021-9606

Lue, L. and Blankschtein, D. (1995) Application of integral equation theories to predict the structure, thermodynamics, and phase-behavior of water. Journal of Chemical Physics, 102 (13). pp. 5427-5437. ISSN 0021-9606

Lue, L. and Blankschtein, D. (1995) Integral equations for interaction site fluids --- The influence of connectivity constraints and auxiliary sites. Journal of Chemical Physics, 102 (13). pp. 5460-5470. ISSN 0021-9606

1994

GONZALEZ, E B and DAEID, N N and NOLAN, K B (1994) Complex formation between transition metal ions and salicylglycine, a metabolite of aspirin. Polyhedron, 13 (10). pp. 1495-1499. ISSN 0277-5387

Lue, L. and Blankschtein, D. (1994) Proper integral equations for interaction-site fluids: Exact free-energy expressions. Journal of Chemical Physics, 100 (4). pp. 3002-3012. ISSN 0021-9606

1993

DAEID, N N and ATKINSON, S T and NOLAN, K B (1993) Synthetic Porphyrins/Metalloporphyrins Which Mimic States in Catalytic Cycle of Cytochrome P-450 and Peroxidases. Pure and Applied Chemistry, 65 (7). pp. 1541-1548. ISSN 0033-4545

DAEID, N N and NOLAN, K B (1993) Oxidised metallophenolicporphyrins as models for compound I of the peroxidases. Reduction of oxidised iron(III), nickel(II) and zinc(II) complexes of meso-tetrakis(3,5-di-t-butyl-4-hydroxyphenyl)prophyrin by the peroxidase substrate p-cresol. Inorganica Chimica Acta, 211 (1). pp. 55-60. ISSN 0020-1693

1992

CLEGG, W and MACGREGOR, M and Mulvey, Robert and ONEIL, P A (1992) Crystal and solution structures of the novel complex of sodium ketimide with two ketimine ligands [(tBu2C = NNa)4(HN = CtBu2)2]: stacking of complexed and uncomplexed (NNa)2 rings to give a highly distorted (NNa)4 cubane. Angewandte Chemie International Edition, 31 (1). pp. 93-95. ISSN 1521-3773

HENDERSON, K W and Mulvey, Robert and CLEGG, W and ONEIL, P A (1992) Reactions of chelating alkali metal amides with the Grignard reagent nBuMgCl: crystal structures and solution 1H NMR spectroscopic studies of the expected mono(amido)-product [PhCH2(Me2NCH2CH2)NMgnBu]2 and the unexpected bis(amido)-product {[Ph(2-Pyr)N]2M9 · (THF)2}. Journal of Organometallic Chemistry, 439 (3). pp. 237-250. ISSN 0022-328X

Lue, L. and Blankschtein, D. (1992) Liquid-state theory of hydrocarbon-water systems: application to methane, ethane, and propane. Journal of Physical Chemistry B, 96 (21). pp. 8582-8594. ISSN 1520-6106

Piazza, Roberto and Degiorgio, Vittorio and Giardini, Mario Ettore and Mantegazza, Francesco; Chen, Sow-Hsin and Huang, John S. and Tartaglia, Piero, eds. (1992) Static and dynamic electric birefringence in model colloidal dispersions of intrinsically anisotropic particles. In: Structure and Dynamics of Strongly Interacting Colloids and Supramolecular Aggregates in Solution. NATO ASI Series . Springer, pp. 557-570. ISBN 9789401051224

1991

ANDREWS, P C and ARMSTRONG, D R and CLEGG, W and MACGREGOR, M and Mulvey, Robert (1991) A new type of structure in sodium amide ring chemistry: crystal structure of [PhCH2(Me)NNa(tmeda)]2 showing a buckled, rather than the normal planar, (NNa)2 cyclic ring, with a cisoid, rather than the normal transoid, arrangement of amido-substituents (tmeda = tetramethylethylenediamine). Journal of the Chemical Society, Chemical Communications (7). pp. 497-498. ISSN 0022-4936

ARMSTRONG, D R and Mulvey, Robert and BARR, D and PORTER, R W and RAITHBY, P R and SIMPSON, T R E and SNAITH, R and WRIGHT, D S and GREGORY, K and MIKULCIK, P (1991) Lithiations of mercaptoamines containing NC(S)NH–,–NHC(S)S– and –NHC(S)NH– units: syntheses, crystal structures and model molecular-orbital calculations. Journal of the Chemical Society, Dalton Transactions (S). pp. 765-776. ISSN 0300-9246

DAEID, N N and NOLAN, K B and RYAN, L P (1991) Copper(II) complexes of hydrolysis products of the anticancer bis(3,5-dioxopiperazin-1-yl)alkanes. Displacement of co-ordinated carboxylate ligands by deprotonated amide groups in basic solution. Journal of the Chemical Society, Dalton Transactions (9). pp. 2301-2304. ISSN 0300-9246

1990

ANDREWS, P C and CLEGG, W and Mulvey, Robert (1990) Lewis-base-dictated structural variations in sodium amide chemistry: X-ray crystal structures of phenyl(2-pyridyl)amidosodium with hexamethylphosphoric triamide (HMPA) and with pentamethyldiethylenetriamine (PMDETA). Angewandte Chemie International Edition, 29 (12). pp. 1440-1441. ISSN 1521-3773

ANDREWS, P C and Mulvey, Robert and CLEGG, W and REED, D (1990) X-ray crystallographic studies and dynamic 1H NMR spectroscopic studies of the novel sodium aza-allyl monomer [PhC(H)NC(H)Ph]Na · PMDETA: A discrete contact ion-pair structure held together by a short NNa bond, and showing close (ortho-Ph)CH ··· Na contacts in both solid state and solution. Journal of Organometallic Chemistry, 386 (3). pp. 287-297. ISSN 0022-328X

1989

ANDREWS, P C and ARMSTRONG, D R and MACGREGOR, M and Mulvey, Robert and REED, D (1989) Lewis base mediated rearrangements of alkali metal imides to η3-aza-allyl complexes: preparation and n.m.r. spectroscopic solution studies of [CH3CH2CH2C(H)C(But)N(H)·M·(HMPA)x]n(M = Li, x= 1; M = Na, x= 2)(HMPA = hexamethylphosphoramide). Journal of the Chemical Society, Chemical Communications (18). pp. 1341-1342. ISSN 0022-4936

ARMSTRONG, D R and BARR, D and CLEGG, W and HODGSON, S M and Mulvey, Robert and REED, D and SNAITH, R and WRIGHT, D S (1989) Ladder structures in lithium amide chemistry: syntheses, solid-state, and solution structures of donor-deficient lithium pyrrolidide complexes, [cyclic] {[H2C(CH2)3NLi]3.cntdot.PMDETA}2 and [cyclic] {[H2C(CH2)3NLi]2.cntdot.TMEDA}2, and ab initio MO calculations probing ring vs ladder vs stack structural preferences. Journal of the American Chemical Society, 111 (13). pp. 4719-4727. ISSN 1520-5126

ARMSTRONG, D R and Mulvey, Robert and BARR, D and SNAITH, R and WRIGHT, D S and CLEGG, W and HODGSON, S M (1989) Dilithiation of N,N′-diphenylthiourea, PhNHC(S)NHPh, in HMPA: the unexpected structure of the product, [PhNPh)SLi·2HMPA]2, and supporting ab initio MO calculations on model systems. Journal of Organometallic Chemistry, 362 (1-2). C1-C4. ISSN 0022-328X

BARR, D and CLEGG, W and HODGSON, S M and LAMMING, G R and Mulvey, Robert and SCOTT, A J and SNAITH, R and WRIGHT, D S (1989) [H2C(CH2)5NLI]6, the first cyclized lithium amide ladder: synthesis and structure of hexamethyleneimidolithium. Angewandte Chemie International Edition, 28 (9). pp. 1241-1243. ISSN 1521-3773

BARR, D and CLEGG, W and Mulvey, Robert and SNAITH, R (1989) Synthesis and crystal structure of the mixed alkali metal imide Li4 -xNa2 +x[NC(Ph)But]6: three (metal–nitrogen)2 ring dimers in a triple-layered stack. Journal of the Chemical Society, Chemical Communications (1). pp. 57-58. ISSN 0022-4936

BARR, D and DOYLE, M J and Mulvey, Robert and RAITHBY, P R and REED, D and SNAITH, R and WRIGHT, D S (1989) A unique lithium halide complex, [(LiBr)2·3HMPA·toluene]: synthesis from reaction of solid NH4Br with BunLi in HMPA (hexamethylphosphoramide)/toluene media, crystal structure showing two Li–Br units linked by three µ2-HMPA ligands, and detection of 7Li 31P coupling in solutions of the complex. Journal of the Chemical Society, Chemical Communications (5). pp. 318-319. ISSN 0022-4936

1988

ARMSTRONG, D R and Mulvey, Robert and BARR, D and SNAITH, R and REED, D (1988) Isolation, characterisation, and solution structures of the bis(pyridine) complex of the n-butyllithium-pyridine adduct, Bun(C5H5N)Li·2C5H5N, its mode of decomposition, and ab initio calculations on model systems. Journal of Organometallic Chemistry, 350 (2). pp. 191-205. ISSN 0022-328X

ARMSTRONG, D R and Mulvey, Robert and WALKER, G T and BARR, D and SNAITH, R and CLEGG, W and REED, D (1988) Syntheses and solid-state structures of trimeric dibenzylamidolithium and its diethyl ether and hexamethylphosphoramide dimeric complexes: an explanation of these structures and evidence for Li CH interactions in both solid and solution phases. Journal of the Chemical Society, Dalton Transactions (3). pp. 617-628. ISSN 0300-9246

BARR, D and CLEGG, W and HODGSON, S M and Mulvey, Robert and REED, D and SNAITH, R and WRIGHT, D S (1988) A Li8 cluster of three edge-connected Li4 tetrahedra held by Li–N, Li C, and Li Li interactions: crystal structure of (o-LiC6H4CH2·NLi·CH2CH2NMe2)4 and detection of metal metal coupling within it by 7Li COSY n.m.r. spectroscopy. Journal of the Chemical Society, Chemical Communications (5). pp. 367-369. ISSN 0022-4936

BARR, D and DOYLE, M J and Mulvey, Robert and RAITHBY, P R and SNAITH, R and WRIGHT, D S (1988) Synthesis and crystal and solution structures of the 1 : 1 TMEDA complex of lithium thiocyanate, (LiSCN·TMEDA)n[TMEDA = Me2N(CH2)2NMe2]: a polymeric solid with Li+ ions linked by bifunctional linear SCN– ligands. Journal of the Chemical Society, Chemical Communications (2). pp. 145-147. ISSN 0022-4936

BARR, D and SNAITH, R and Mulvey, Robert and PERKINS, P G (1988) MOLECULAR-ORBITAL BOND INDEX (MOBI) CALCULATIONS ON SELECTED ORGANO-LITHIUM AND LITHIUM ATE SPECIES - EVIDENCE FOR LI=H-C 3-CENTER INTERACTIONS. Polyhedron, 7 (21). pp. 2119-2128. ISSN 0277-5387

1987

BARR, D and CLEGG, W and Mulvey, Robert and SNAITH, R and WRIGHT, D S (1987) Three model structural types in lithium amide chemistry: the crystal and molecular structures of dimeric [Ph(Me)NLi·TMEDA]2(TMEDA = Me2NCH2CH2NMe2) and monomeric Ph(naphthyl)NLi·PMDETA [PMDETA = MeN(CH2CH2NMe2)2], and of [Ph(naphthyl)NLi·TMEDA]2, a ‘loose dimer’. Journal of the Chemical Society, Chemical Communications (10). pp. 716-718. ISSN 0022-4936

BARR, D and SNAITH, R and CLEGG, W and Mulvey, Robert and WADE, K (1987) The syntheses and crystal structures of two iminolithium adducts: (Ph2CNLi·NC5H5)4, a tetrameric pseudo-cubane formed by stacking two (LiN)2 four-membered rings, and [But2CNLi·OP(NMe2)3]2, a dimer prevented sterically from stacking. Journal of the Chemical Society, Dalton Transactions (9). pp. 2141-2147. ISSN 0300-9246

BARR, D and SNAITH, R and WRIGHT, D S and Mulvey, Robert and JEFFREY, K and REED, D (1987) Isolation and solution structures of {PhCH2NLiCH2CH2NMe2} n and of the totally rigid dilithium compound, {o-LiC6H4CH2NLiCH2CH2NMe2} n ; evidence for Li…o-HC interactions. Journal of Organometallic Chemistry, 325 (1-2). C1-C6. ISSN 0022-328X

BARR, D and SNAITH, R and WRIGHT, D S and Mulvey, Robert and WADE, K (1987) Reactions of ammonium salts with butyllithium and with lithium hydride: new routes to fully anhydrous inorganic lithium complexes. Journal of the American Chemical Society, 109 (25). pp. 7891-7893. ISSN 1520-5126

Mulvey, Robert and WADE, K and ARMSTRONG, D R and WALKER, G T and SNAITH, R and CLEGG, W and REED, D (1987) X-ray crystallographic and solution studies of the pentamethyldiethylenetriamine and tetramethylethylenediamine adducts of lithium diphenylphosphide. Polyhedron, 6 (5). pp. 987-993. ISSN 0277-5387

Wanogho, S. and Gettinby, G. and Caddy, B. (1987) Particle-size distribution analysis of soils using laser diffraction. Forensic Science International, 33 (2). pp. 117-128. ISSN 0379-0738

1986

BARR, D and SNAITH, R and Mulvey, Robert and WADE, K and REED, D (1986) Variable-temperature and-concentration 1H and 7Li NMR studies of solutions of hexameric iminolithium compounds, (R1R2CNLi)6. Magnetic Resonance in Chemistry, 24 (8). pp. 713-717.

Bovill, A.J. and McConnell, A.A. and Nimmo, J.A. and Smith, W.E. (1986) Resonance raman-spectra of alpha-copper phthalocyanine. Journal of physical chemistry, 90 (4). pp. 569-575. ISSN 0022-3654

CLEGG, W and Mulvey, Robert and SNAITH, R and TOOGOOD, G E and WADE, K (1986) The synthesis and X-ray structural characterisation of the first mixed alkali metal organonitrogen molecular cluster LiNa3[OP(NMe2)3]3[NC(NMe2)2]4. Journal of the Chemical Society, Chemical Communications (23). pp. 1740-1742. ISSN 0022-4936

Mulvey, Robert and ONEILL, M E and WADE, K and SNAITH, R (1986) Bond indices, enthalpies and relative stabilities of real and hypothetical closo-BnHc−n clusters (n = 5–12; c = 0, 2 or 4) as revealed by the molecular-orbital bond index method. Polyhedron, 5 (9). pp. 1437-1447. ISSN 0277-5387

REED, D and BARR, D and Mulvey, Robert and SNAITH, R (1986) High-field lithium-7 nuclear magnetic resonance spectroscopic and cryoscopic relative molecular mass studies on solutions of amido- and imido-lithium compounds. Journal of the Chemical Society, Dalton Transactions (3). pp. 557-564. ISSN 0300-9246

Richards, R.W. and Davidson, N.S. (1986) Scaling analysis of mechanical and swelling properties of random polystyrene networks. Macromolecules, 19 (5). pp. 1381-1389. ISSN 0024-9297

1985

Davidson, N.S. and Richards, R.W. and Geissler, E. (1985) Scaling laws and polystyrene networks - a quasi-elastic light-scattering study. Polymer, 26 (11). pp. 1643-1646. ISSN 0032-3861

HOUSECROFT, C E and SNAITH, R and MOSS, K and Mulvey, Robert and ONEILL, M E and WADE, K (1985) Cluster bonding and energetics of the borane anions, BnHn2− (n = 5–12): A comparative study using bond length—bond enthal. Polyhedron, 4 (11). pp. 1875-1881. ISSN 0277-5387

1973

Miller, J.A. and Black, Rona and Larkin, J. and Nonhebel, D.C. and Wood, H.C.S., Scrimego.C.M (1973) Formation of 1,1-dimethylallyl derivatives by reaction of 3,3-dimethylallyl halides with copper(ii) chelates of acetylacetone and methyl acetoacetate. Journal of the Chemical Society, Perkin Transactions 1 (6). pp. 603-606. ISSN 1472-7781