Zobrazeno 1 - 5
of 5
pro vyhledávání: '"T. O. H. White"'
Autor:
R. P. Bruin, Ilian T. Todorov, Helen F. Chappell, Stephen C. Parker, I Frame, Martin T. Dove, J. M. Pruneda, T. O. H. White, Arnaud Marmier, Andrew Walker, Kostya Trachenko, Gen-Tao Chiang, Kerstin Kleese van Dam, Kat Austen, M. Calleja, Emilio Artacho, Andrew L. Goodwin, R. P. Tyer, Ekhard K. H. Salje
Publikováno v:
Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences. 367:967-985
We review the work carried out within the e Minerals project to develop eScience solutions that facilitate a new generation of molecular-scale simulation work. Technological developments include integration of compute and data systems, developing of
Publikováno v:
Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences. 367:1051-1056
We describe the use of new eScience tools to support collaboration, including the use of XML data representations to support shared viewing of the information content of data, metadata tools for documenting data and Web 2.0 social networking tools fo
Autor:
R. P. Bruin, T. O. H. White, A. M. Walker, K. F. Austen, M. T. Dove, R. P. Tyer, P. A. Couch, I. T. Todorov, M. O. Blanchard
Publikováno v:
Concurrency and Computation: Practice and Experience. 20:1329-1340
Autor:
Martin T. Dove, Kostya Trachenko, Kerstin Kleese van Dam, R. P. Bruin, L. A. Sullivan, T. O. H. White, Peter Murray-Rust, Ilian T. Todorov, William A. P. Smith, Andrew Walker, R. P. Tyer, P. A. Couch
Publikováno v:
Molecular Simulation. 32:945-952
We use the example of a study of the compressibility anomaly in amorphous silica to illustrate how molecular-scale simulations can be performed using grid computing. The potential for running many simulations within a single study requires the use of
Publikováno v:
Philosophical transactions. Series A, Mathematical, physical, and engineering sciences. 367(1890)
A collaborative environmental eScience project produces a broad range of data, notable as much for its diversity, in source and format, as its quantity. We find that extensible markup language (XML) and associated technologies are invaluable in manag