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Details of Grant 

EPSRC Reference: GR/R67729/01
Title: Structure-Property Mapping: Combination Chemistry & the grid (CombiChem)
Principal Investigator: Frey, Professor JG
Other Investigators:
Moreau, Professor L Welsh, Professor A Hursthouse, Professor M
Essex, Professor JW Orpen, Professor A Lewis, Professor SM
De Roure, Professor D Luck, Professor M
Researcher Co-Investigators:
Project Partners:
Department: School of Chemistry
Organisation: University of Southampton
Scheme: Standard Research (Pre-FEC)
Starts: 01 October 2001 Ends: 31 March 2005 Value (£): 2,314,665
EPSRC Research Topic Classifications:
Artificial Intelligence Chemical Structure
Combinatorial Chemistry Information & Knowledge Mgmt
EPSRC Industrial Sector Classifications:
Creative Industries Chemicals
Communications Pharmaceuticals and Biotechnology
Information Technologies
Related Grants:
Panel History:  
Summary on Grant Application Form
The synthesis of new compounds by combinatorial methods provides major opportunities for the generation of large volumes of new chemcial knowledge. An extensive range of primary data needs to be accumulated, integrated and relationships modelled, so that maximum knowledge can be derived. The goal of the CombiChem project is to develop an e-science testbed that integrates existing structure and property data sources within a grid-based information-and knowledge-sharing environment. The service-based grid computing infrastructure extends to devices in the laboratory and involves enriched streams, (including multimedia and live metadata), full support for provenance and innovative techniques for automation throughout the environment.
Key Findings
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Potential use in non-academic contexts
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Impacts
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Summary
Date Materialised
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Project URL:  
Further Information:  
Organisation Website: http://www.soton.ac.uk