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Number of items: 17.

January 2011

Chiang, Gen-Tao and White, Toby O. H. and Dove, Martin T. and Bovolo, C. Isabella and Ewen, John (2011) Geo-visualization Fortran library. Computers & Geosciences, 37 (1). pp. 65-74. DOI 10.1016/j.cageo.2010.04.012

March 2009

Walker, A. M. and Bruin, R. P. and Dove, M. T. and White, T. O. H. and Kleese van Dam, K and Tyer, R.P (2009) Integrating computing, data and collaboration grids: the RMCS tool. Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, 367 (1890). pp. 1047-1050. DOI 10.1098/rsta.2008.0159

White, T. O. H. and Bruin, R. P. and Chiang, G. T. and Dove, M. T. and Tyer, R. P. and Walker, A. M. (2009) Lessons in scientific data interoperability: XML and the eMinerals project. Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, 367 (1890). pp. 1041-1046. DOI 10.1098/rsta.2008.0175

Frame, I. and Austen, K. F. and Calleja, M and Dove, M. T. and White, T. O. H. and Wilson, D.J (2009) New tools to support collaboration and virtual organizations. Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, 367 (1890). pp. 1051-1056. DOI 10.1098/rsta.2008.0193

Salje, E. K. H. and Artacho, E. and Austen, K. F. and Bruin, R. P. and Calleja, M. and Chappell, H. F. and Chiang, G. T. and Dove, M. T. and Frame, I. and Goodwin, A. L. and Kleese van Dam, K. and Marmier, A. and Parker, S. C. and Pruneda, J. M. and Todorov, I. T. and Trachenko, K. and Tyer, R. P. and Walker, A. M. and White, T. O. H. (2009) eScience for molecular-scale simulations and the eMinerals project. Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, 367 (1890). pp. 967-985. DOI 10.1098/rsta.2008.0195

February 2008

Bruin, R. P. and White, T. O. H. and Walker, A. M. and Austen, K. F. and Dove, M. T. and Tyer, R. P. and Couch, P. A. and Todorov, I. T. and Blanchard, M. O. (2008) Job submission to grid computing environments. Concurrency and Computation: Practice and Experience, 20 (11). pp. 1329-1340. DOI 10.1002/cpe.1290

2008

Austen, K. F. and White, T. O. H. and Marmier, A. and Parker, S. C. and Artacho, E. and Dove, M. T. (2008) Electrostatic versus polarization effects in the adsorption of aromatic molecules of varied polarity on an insulating hydrophobic surface. Journal of Physics: Condensed Matter, 20 (3). 035215. DOI 10.1088/0953-8984/20/03/035215

2007

Walker, A. M. and Sullivan, L. A. and Trachenko, K. and Bruin, R. P. and White, T. O. H. and Dove, M. T. and Tyer, R. P. and Todorov, I. T. and Wells, S. A. (2007) Origin of the compressibility anomaly in amorphous silica. Journal of Physics: Condensed Matter, 19 (275210). p. 275210. DOI 10.1088/0953-8984/19/27/275210

2006

Walker, A. M. and Dove, M. T. and Sullivan, L. A. and Trachenko, K. and Bruin, R. P. and White, T. O. H. and Murray-Rust, P. and Tyer, R. P. and Couch, P. A. and Todorov, I. T. and Smith, W. and Kleese van Dam, K. (2006) Anatomy of a grid-enabled molecular simulation study: the compressibility of amorphous silica. In: Proceedings of the UK e-Science All Hands Meeting 2006. UK e-Science, pp. 653-660. ISBN 0955398800

White, T. O. H. and Murray-Rust, P. and Couch, P. A. and Tyer, R. P. and Bruin, R. P. and Todorov, I. T. and Wilson, D. J. and Dove, M. T. and Austen, K. F. and Parker, S. C. (2006) Application and uses of CML within the eMinerals project. In: Proceedings of the UK e-Science All Hands Meeting 2006. National eScience Centre, pp. 606-613. ISBN 0955398800

Tyer, R. P. and Couch, P. A. and Kleese van Dam, K. and Todorov, I. T. and Bruin, R. P. and White, T. O. H. and Walker, A. M. and Austen, K. F. and Dove, M. T. and Blanchard, M. O. (2006) Automatic metadata capture and grid computing. In: Proceedings of the UK e-Science All Hands Meeting 2006. National eScience Centre, pp. 381-384. ISBN 0955398800

Bruin, R. P. and White, T. O. H. and Walker, A. M. and Austen, K. F. and Dove, M. T. and Tyer, R. P. and Couch, P. A. and Todorov, I. T. and Blanchard, M. O. (2006) Job submission to grid computing environments. In: Proceedings of the UK e-Science All Hands Meeting 2006. National eScience Centre, pp. 754-761. ISBN 0955398800

Dove, M. T. and Sullivan, L. A. and Walker, A. M. and Bruin, R. P. and White, T. O. H. and Trachenko, K. and Murray-Rust, P. and Todorov, I. T. and Tyer, R. P. and Couch, P. A. and Kleese van Dam, K. and Smith, W. (2006) Molecular dynamics in a grid computing environment: experiences using DL_POLY_3 within the eMinerals escience project. Molecular Simulation, 32 (12-13). pp. 945-952. DOI 10.1080/08927020600883293

Austen, K. F. and White, T. O. H. and Bruin, R. P. and Dove, M. T. and Artacho, E. and Tyer, R. P. (2006) Using eScience to calibrate our tools: parameterisation of quantum mechanical calculations with grid technologies. In: Proceedings of the UK e-Science All Hands Meeting 2006. UK e-Science, pp. 645-652. ISBN 0955398800

White, T. O. H. and Tyer, R. P. and Bruin, R. P. and Dove, M. T. and Austen, K. F. (2006) A lightweight, scriptable, web-based frontend to the SRB. In: Proceedings of the UK e-Science All Hands Meeting 2006. National eScience Centre, pp. 209-216. ISBN 0955398800

Du, Z. and Alexander, V. N. and Alfredsson, M. and Artacho, E. and Austen, K. F. and Bennett, N. D. and Blanchard, M. and Brodholt, J. P. and Bruin, R. P. and Catlow, C. R. A. and Chapman, C. and Cooke, D. J. and Cooper, T. G. and Dove, M. T. and Emmerich, W. and Hasan, S. M. and Kerisit, S. and de Leeuw, N. H. and Lewis, G. J. and Marmier, A. and Parker, S. C. and Price, G. D. and Smith, W. and Todorov, I. T. and Tyer, R. and Kleese van Dam, K. and Walker, A. M. and White, T. O. H. and Wright, K. (2006) A virtual research organization enabled by eMinerals minigrid: An integrated study of the transport and immobilisation of arsenic species in the environment. In: Proceedings of the UK e-Science All Hands Meeting 2006. National eScience Centre, pp. 481-488. ISBN 0955398800

September 2005

White, T. O. and Bruin, R. P. and Wakelin, J. and Chapman, C. and Osborn, D. and Murray-Rust, P. and Artacho, E. and Dove, M. T. and Calleja, M. (2005) eScience methods for the combinatorial chemistry problem of adsorption of pollutant organic molecules on mineral surfaces. In: Proceedings of the UK e-Science All Hands Meeting 2005. EPSRC, pp. 773-780. ISBN 1904425534

This list was generated on Mon Aug 21 09:00:16 2017 BST.

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