Institution: | 1. Centre for Computational Science, Christopher Ingold Laboratories , University College London , 20 Gordon Street, London, WC1H 0AJ, UK;2. Centre for Computational Science, Christopher Ingold Laboratories , University College London , 20 Gordon Street, London, WC1H 0AJ, UK E-mail: P.V.Coveney@ucl.ac.uk;3. Manchester Computing , The University of Manchester , Oxford Road, Kilburn Building, Manchester, M13 9PL, UK;4. Centre for Computational Science, Christopher Ingold Laboratories , University College London , 20 Gordon Street, London, WC1H 0AJ, UK;5. Manchester Computing , The University of Manchester , Oxford Road, Kilburn Building, Manchester, M13 9PL, UK |