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The Accelrys 2008 Science & Technology Forums - Cambridge, UK

Thursday, 26 June 2008

Chemicals/Materials

8:30

Welcome Coffee & Registration

9:00

Chairperson's Event Introduction:
Roger Cracknell, Senior Scientist, Shell

9:15

Using DFT Calculations to Determine the Chemical Origin of Octane Sensitivity in Gasoline Fuels Containing Nitro-alkanes View Abstract >>>
Neal Morgan, Marie Curie Research Fellow, Shell Research Centre & University of Cambridge

9:45

From Nanotubes to Graphene: Aspects of the Modelling of Low Dimensional Carbon Systems and Possible Applications
View Abstract >>>

David Carey, Director of MSc in Nanotechnology and Nanoelectronic Devices, University of Surrey

10:15

Engineering Polymer Informatics - Working Towards the Computer-Aided Design of Polymers View Abstract>>>
Nico Adams, Unilever Centre for Molecular Science Informatics

10:45

Coffee Break

11:15

Multiscale Modelling of Structural Materials : non linear polymer properties
View Abstract >>>

David Porter, Oxford University

11:45

Accelrys New Science:
An Analytical Collection for SciTegic Enterprise Server

View Abstract >>>

Dave Nicolaides, Principal Scientist, Accelrys

High Throughput Ab Initio Calculations for Metal Catalysts: Merits and Challenges
View Abstract>>>
Jacob Gavartin, Senior Scientist - Professional Services

12:35

Lunch

14:00

Recent Advances in Mesoscale Modeling
Stephen Todd, Senior Product Marketing Manager

14:30

Open Discussion with Speaker Panel
Hands-on Session: Materials Studio 4.3

15:45

Coffee Break

16:15

Hands-on Session Continued

17:00

Chairperson's Closing Remarks
Roger Cracknell, Senior Scientist, Shell