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  Computational Studies on the Interactions of Inhalational Anesthetics with Proteins

  Vemparala, S., Domene Nunez, C. & Klein, M. L., 1 Jan 2010, In: Accounts of Chemical Research. 43, 1, p. 103-110 8 p.

  Research output: Contribution to journal › Article › peer-review
  9 Citations (SciVal)

• Computational study of carbostannylation implicating bimetallic catalysis involving "au^I-Vinyl-Pd^II" species

  Ariafard, A., Rajabi, N. A., Jalali Atashgah, M., Canty, A. J. & Yates, B. F., 7 Mar 2014, In: ACS Catalysis. 4, 3, p. 860-869 10 p.

  Research output: Contribution to journal › Article › peer-review
  6 Citations (SciVal)

• Computational study of electrophilic addition to acrylate anion: cyclic halonium is the transition structure for degenerate rearrangement of alpha-lactones

  Ruggiero, G. D. & Williams, I. H., 2002, In: Chemical Communications. 7, p. 732-733 2 p.

  Research output: Contribution to journal › Article › peer-review
  2 Citations (SciVal)

• Computational Study of NaVOPO₄ Polymorphs as Cathode Materials for Na-Ion Batteries: Diffusion, Electronic Properties, and Cation-Doping Behavior

  Aparicio, P. A., Dawson, J. A., Islam, M. S. & De Leeuw, N. H., 15 Nov 2018, In: Journal of Physical Chemistry C. 122, 45, p. 25829-25836

  Research output: Contribution to journal › Article › peer-review

  Open Access
  20 Citations (SciVal)

• Computational study of the blood flow in three types of 3D hollow fiber membrane bundles

  Zhang, J., Chen, X., Ding, J., Fraser, K. H., Taskin, M. E., Griffith, B. P. & Wu, Z. J., 1 Dec 2013, In: Journal Of Biomechanical Engineering. 135, 12, p. 121009 1 p.

  Research output: Contribution to journal › Article › peer-review
  10 Citations (SciVal)

• Computational study of the hydrodefluorination of fluoroarenes at [Ru(NHC)(PR₃)₂(CO)(H)₂]: Predicted scope and regioselectivities

  MacGregor, S. A., McKay, D., Panetier, J. A. & Whittlesey, M. K., 28 May 2013, In: Dalton Transactions. 42, 20, p. 7386-7395 10 p.

  Research output: Contribution to journal › Article › peer-review
  21 Citations (SciVal)

• Computational Techniques Used in the Driver Performance Model of the Interactive Highway Safety Design Model

  Levison, W. H., Şimşek, Ö., Bittner, A. C. & Hunn, S. J., 1 Jan 2001, In: Transportation Research Record. 1779, 1, p. 17–25 9 p., 01-2187.

  Research output: Contribution to journal › Article › peer-review
  1 Citation (SciVal)

• Computational tool for failure modes and effects analysis of hydraulic systems

  Bull, D. R., Burrows, C. R., Edge, K. A., Hawkins, P. G. & Woollons, D. J., 1996, In: American Society of Mechanical Engineers, The Fluid Power and Systems Technology Division (Publication) FPST. 3, p. 113-118 6 p.

  Research output: Contribution to journal › Article › peer-review

• Computation and drug design

  Williams, I., Aug 2000, In: Newsline. 2000, August, p. 23-23 1 p.

  Research output: Contribution to journal › Article

• Computation of extreme eigenvalues in higher dimensions using block tensor train format

  Dolgov, S. V., Khoromskij, B. N., Oseledets, I. V. & Savostyanov, D. V., 1 Apr 2014, In: Computer Physics Communications. 185, 4, p. 1207-1216 10 p.

  Research output: Contribution to journal › Article › peer-review
  31 Citations (SciVal)

• Computation of flow between two discs rotating at different speeds

  Kilic, M. & Owen, J. M., 2003, In: Journal of Turbomachinery: Transactions of the ASME. 125, 2, p. 394-400

  Research output: Contribution to journal › Article › peer-review

• Computation of homoclinic orbits in partial differential equations: An application to cylindrical shell buckling

  Lord, G. J., Champneys, A. R. & Hunt, G. W., 1999, In: SIAM Journal on Scientific Computing. 21, 2, p. 591-619 29 p.

  Research output: Contribution to journal › Article › peer-review

  5 Citations (SciVal)

• Computation of ingestion through gas turbine rim seals

  Zhou, K., Wilson, M., Owen, J. M. & Lock, G. D., 1 Jul 2013, In: Proceedings of the Institution of Mechanical Engineers Part G - Journal of Aerospace Engineering. 227, 7, p. 1101-1113 13 p.

  Research output: Contribution to journal › Article › peer-review
  3 Citations (SciVal)

• Computation of localized post buckling in long axially compressed cylindrical shells

  Lord, G. J., Champneys, A. R. & Hunt, G. W., 1997, In: Philosophical Transactions of the Royal Society A - Mathematical Physical and Engineering Sciences. 355, 1732, p. 2137-2150 14 p.

  Research output: Contribution to journal › Article › peer-review

  12 Citations (SciVal)

• Computation of losses in HTS under the action of varying magnetic fields and currents

  Grilli, F., Pardo, E., Stenvall, A., Nguyen, D. N., Yuan, W. & Gomory, F., 2014, In: IEEE Transactions on Applied Superconductivity. 24, 1, 6648727.

  Research output: Contribution to journal › Article › peer-review

  Open Access
  136 Citations (SciVal)

• Computation of self-similar solution profiles for the nonlinear Schrodinger equation

  Budd, C., Koch, O. & Weinmuller, E., 2006, In: Computing. 77, 4, p. 335-346 12 p.

  Research output: Contribution to journal › Article › peer-review

  2 Citations (SciVal)

• Computation of three-dimensional flexural-gravity solitary waves in arbitrary depth

  Wang, Z., Milewski, P. A. & Vanden-Broeck, J-M., 2014, In: Procedia IUTAM. 11, p. 119-129 11 p.

  Research output: Contribution to journal › Article › peer-review

  File
  4 Citations (SciVal)

  137 Downloads (Pure)

• Computation Provides Chemical Insight into the Diverse Hydride NMR Chemical Shifts of [Ru(NHC)₄(L)H]^0/+ Species (NHC = N-heterocyclic carbene; L = vacant, H₂, N₂, CO, MeCN, O₂, P₄, SO₂, H^-, F^- and Cl^-) and their [Ru(R₂PCH₂CH₂PR₂)₂(L)H]⁺ Congeners

  Haller, L. J. L., Mas-Marza, E., Cybulski, M. K., Sanguramath, R. A., Macgregor, S. A., Mahon, M. F., Raynaud, C., Russell, C. A. & Whittlesey, M. K., 7 Mar 2017, In: Dalton Transactions . 46, p. 2861-2873

  Research output: Contribution to journal › Article › peer-review

  Open Access

  File
  13 Citations (SciVal)

  221 Downloads (Pure)

• Computations of flow and heat transfer in a rotor-stator system with externally-induced ingestion

  Wang, L. & Wilson, M., Feb 2012, In: International Journal of Gas Turbine, Propulsion and Power Systems. 4, 1, p. 10-18 9 p.

  Research output: Contribution to journal › Article › peer-review

  1 Citation (SciVal)

• Computer aided assessment and feedback – can we enhance students’ early experience at University?

  Price, G. J., 2006, In: New Directions in Teaching Physical Sciences. 2, p. 35-40 6 p.

  Research output: Contribution to journal › Article › peer-review

• Computer-aided design and manufacture of hot forging dies

  Chan, Y. K., Mullineux, G. & Knight, W. A., 1980, In: Metallurgia. 47, 1, p. 24-30 7 p.

  Research output: Contribution to journal › Article › peer-review

• Computer-aided design of metal chalcohalide semiconductors: from chemical composition to crystal structure

  Davies, D., Butler, K., Skelton, J., Xie, C., Oganov, A. & Walsh, A., 28 Jan 2018, In: Chemical Science. 9, 4, p. 1022 - 1030 9 p.

  Research output: Contribution to journal › Article › peer-review

  Open Access
  28 Citations (SciVal)

  21 Downloads (Pure)

• Computer-Aided Design of Nanoceria Structures as Enzyme Mimetic Agents: The Role of Bodily Electrolytes on Maximizing Their Activity

  Molinari, M., Symington, A., Sayle, D. C., Sakthivel, T., Seal, S. & Parker, S., 18 Mar 2019, In: ACS Applied Biomaterials. 2, 3, p. 1098-1106 9 p.

  Research output: Contribution to journal › Article › peer-review

  Open Access

  File
  10 Citations (SciVal)

  154 Downloads (Pure)

• Computer-aided process planning: a critical review of recent developments and future trends

  Xu, X., Wang, L. H. & Newman, S. T., Jan 2011, In: International Journal of Computer Integrated Manufacturing. 24, 1, p. 1-31 31 p.

  Research output: Contribution to journal › Article › peer-review
  141 Citations (SciVal)

• Computer-Aided Teaching Using Animations for Engineering Curricula: A Case Study for Automotive Engineering Modules

  Asef, P. & Kalyvas, C., 1 May 2022, In: IEEE Transactions on Education. 65, 2, p. 141-149 9 p.

  Research output: Contribution to journal › Article › peer-review

• Computer assisted animation: 2D or not 2D?

  Patterson, J. W. & Willis, P., 1994, In: The Computer Journal. 37, 10, p. 829-839 11 p.

  Research output: Contribution to journal › Article › peer-review

• Computer-assisted beat-pattern analysis and the flagellar waveforms of bovine spermatozoa

  Walker, B. J., Phuyal, S., Ishimoto, K., Tung, C. K. & Gaffney, E. A., 17 Jun 2020, In: Royal Society Open Science. 7, 6, 200769.

  Research output: Contribution to journal › Article › peer-review

  Open Access
  3 Citations (SciVal)

• Computer assisted testing of spoken english: A study of the SFLEP college english oral test system in China

  Lowe, J. & Yu, X., 2009, In: Journal of Systemics, Cybernetics and Informatics. 7, 3, p. 33-38 10 p.

  Research output: Contribution to journal › Article › peer-review

• Computer-based tools and methods of competitive engineering

  Horvath, I., Vergeest, J. S. M. & Medland, A. J., 2002, In: Computer-Aided Design. 34, 12, p. 869-870 2 p.

  Research output: Contribution to journal › Article › peer-review

• Computerised cognitive behavioural therapy for the prevention and treatment of depression and anxiety in children and adolescents: a systematic review

  Richardson, T., Stallard, P. & Velleman, S., Sep 2010, In: Clinical Child and Family Psychology Review. 13, 3, p. 275-290 16 p.

  Research output: Contribution to journal › Article › peer-review
  83 Citations (SciVal)

• Computerised patient-specific guidelines for management of common mental disorders in primary care: a randomised controlled trial

  Thomas, H. V., Lewis, G., Watson, M., Bell, T., Lyons, I., Lloyd, K., Weich, S. & Sharp, D., Nov 2004, In: British Journal of General Practice. 54, 508, p. 832-837 6 p.

  Research output: Contribution to journal › Article › peer-review

  3 Citations (SciVal)

• Computerization Movements and Technology Diffusion. From Mainframes to Ubiquitous Computing (Review)

  Tonkin, E., Apr 2008, In: Ariadne. 55

  Research output: Contribution to journal › Article

• Computerized CBT (Think, Feel, Do) for depression and anxiety in children and adolescents: outcomes and feedback from a pilot randomized controlled trial

  Stallard, P., Richardson, T., Velleman, S. & Attwood, M., May 2011, In: Behavioural and Cognitive Psychotherapy. 39, 3, p. 273-284 12 p.

  Research output: Contribution to journal › Article › peer-review

  File
  39 Citations (SciVal)

  1196 Downloads (Pure)

• Computer modeling of electromagnetic and thermal effects in microwave soft tissue ablation

  Cronin, N. J., May 2005, In: Proceedings of SPIE. 5698, p. 207-219 13 p.

  Research output: Contribution to journal › Article › peer-review

• Computer modelling and experimental validation of smooth muscle cell growth using matrigel as a basement membrane matrix

  Kirk, C. S., Bodamyali, T., Stevens, C. R. & Mileham, A. R., 2002, In: European Cells and Materials. IV, Supplement 2, p. 15-Abstracts of TCES 2002

  Research output: Contribution to journal › Article › peer-review

• Computer modelling of defects and transport in perovskite oxides

  Islam, M. S., 2002, In: Solid State Ionics. 154, p. 75-85 11 p.

  Research output: Contribution to journal › Article › peer-review

  21 Citations (SciVal)

• Computer numerical control machine tool information reusability within virtual machining systems

  Vichare, P., Dhokia, V., Zhang, X., Cheung, W. M., Xiao, W. & Zheng, L., 1 Mar 2018, In: Proceedings of the Institution of Mechanical Engineers, Part B: Journal of Engineering Manufacture. 232, 4, p. 593-604 12 p.

  Research output: Contribution to journal › Article › peer-review

  Open Access

  File
  5 Citations (SciVal)

  345 Downloads (Pure)

• Computerphobia: Is it a particularly female phenomenon?

  Brosnan, M. & Davidson, M., 1994, In: The Psychologist. 7, 2, p. 73-78 6 p.

  Research output: Contribution to journal › Article › peer-review

• Computers and Physical Education Teachers: a rationale for use and a small scale study into physical education teachers' attitudes towards and use of computers

  Bush, A. J., Mar 2004, In: The British Journal of Teaching Physical Education. 35, p. 45--49 5 p.

  Research output: Contribution to journal › Article › peer-review

• Computer science unplugged: school students doing real computing without computers

  Bell, T., Alexander, J., Freeman, I. & Grimley, M., 2009, In: New Zealand Journal of Applied Computing and Information Technology. 13, 1, p. 20-29 10 p.

  Research output: Contribution to journal › Article › peer-review

  Open Access

  File
  1764 Downloads (Pure)

• Computer Simulation in Daylight Design: a comparison

  Ashmore, J. & Richens, P. N., Mar 2001, In: Architectural Science Review. 44, 1, p. 33-44 12 p.

  Research output: Contribution to journal › Article › peer-review

  3 Citations (SciVal)

• Computer simulation of defect clusters in UO2 and their dependence on composition

  Brincat, N., Molinari, M., Parker, S. C., Allen, G. C. & Storr, M. T., 1 Jan 2015, In: Journal of Nuclear Materials. 456, p. 329-333

  Research output: Contribution to journal › Article › peer-review

  Open Access

  File
  21 Citations (SciVal)

  156 Downloads (Pure)

• Computer simulation of driver working memory processing

  Kong, F. & Sui, J., Oct 2005, In: Proceedings of the Institution of Mechanical Engineers, Part D: Journal of Automobile Engineering. 219, 10, p. 1165-1171 7 p.

  Research output: Contribution to journal › Article › peer-review

• Computer simulation of volatile organic compound adsorption in atomistic models of molecularly imprinted polymers

  Herdes, C. & Sarkisov, L., 5 May 2009, In: Langmuir. 25, 9, p. 5352-5359 8 p.

  Research output: Contribution to journal › Article › peer-review
  16 Citations (SciVal)

• Computer use and attitudes towards computerised therapy amongst young people and parents attending Child and Adolescent Mental Health Services

  Stallard, P., Velleman, S. & Richardson, T., May 2010, In: Child and Adolescent Mental Health. 15, 2, p. 80-84 5 p.

  Research output: Contribution to journal › Article › peer-review
  24 Citations (SciVal)

• Computing diffusivities from particle models out of equilibrium

  Embacher, P., Dirr, N., Zimmer, J. & Reina, C., 25 Apr 2018, In: Proceedings of the Royal Society A: Mathematical Physical and Engineering Sciences. 474, 2212, 20170694.

  Research output: Contribution to journal › Article › peer-review

  Open Access

  File
  8 Citations (SciVal)

  24 Downloads (Pure)

• Computing kinetic isotope effects for chorismate mutase with high accuracy. A new DFT/MM strategy

  Marti, S., Moliner, V., Tunon, M. & Williams, I. H., 2005, In: Journal of Physical Chemistry B. 109, 9, p. 3707-3710 4 p.

  Research output: Contribution to journal › Article › peer-review
  4 Citations (SciVal)

• Computing layouts with deformable templates

  Peng, C-H., Yang, Y-L. & Wonka, P., 31 Jul 2014, In: ACM Transactions on Graphics. 33, 4, p. 1-11 11 p., 99.

  Research output: Contribution to journal › Article › peer-review

  Open Access

  File
  35 Citations (SciVal)

  299 Downloads (Pure)

• Computing modular coincidences for substitution tilings and point sets

  Frettloh, D. & Sing, B., 2007, In: Discrete & Computational Geometry. 37, 3, p. 381-407 27 p.

  Research output: Contribution to journal › Article › peer-review
  2 Citations (SciVal)

• Computing the critical dimensions of Bratteli–Vershik systems with multiple edges

  Dooley, A. H. & Hagihara, R., Feb 2012, In: Ergodic Theory and Dynamical Systems. 32, 01, p. 103-117 15 p.

  Research output: Contribution to journal › Article › peer-review
  1 Citation (SciVal)