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Digital Future for Chemical Information

Explore the challenges and importance of chemical information, including data, relationships, and terminology in a digital world. Discover the significance of ontology and the need for intelligent access. Join the discussion on enabling computers to understand chemical terminology clearly.

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Digital Future for Chemical Information

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  1. i-UPAC Jeremy Frey Chemistry, University of Southampton, UK j.g.frey@soton.ac.uk @profehem Jeremy G. Frey

  2. PURE Jeremy G. Frey cc: larces - https://www.flickr.com/photos/23629727@N02

  3. APPLIED Jeremy G. Frey cc: Gerard Stolk (vers le Carême) - https://www.flickr.com/photos/20762304@N00

  4. DEFINITIONS Jeremy G. Frey cc: fabianmohr - https://www.flickr.com/photos/78101915@N00

  5. RELATIONSHIPS Jeremy G. Frey cc: tuchodi - https://www.flickr.com/photos/35034360491@N01

  6. HUMAN Jeremy G. Frey cc: Macroscopic Solutions - https://www.flickr.com/photos/107963674@N07

  7. MACHINE Jeremy G. Frey cc: Pierre J. - https://www.flickr.com/photos/7969902@N07

  8. INTELEGENT Jeremy G. Frey cc: --Filippo-- - https://www.flickr.com/photos/71882589@N00

  9. ACCESS Jeremy G. Frey cc: JenWaller - https://www.flickr.com/photos/8392849@N07

  10. Chemical Information • Chemical information includes the data, quantities, concepts, relationships, standards, terminology and definitions key to understanding chemistry (in context). • The digital future for structural representation is provided for - InChI – but what of other chemical information? • Bioinformatics has been widely supported by governmental funds; cheminformatics far less so • Royal Society report on Science as an Open Enterprise – “intelligent access”iskey in a digital world • The Challenge - Enabling computers to understand chemical terminology and relationships unambiguously Jeremy G. Frey

  11. DIGITAL Jeremy G. Frey cc: quimby - https://www.flickr.com/photos/92388598@N00

  12. DATA DRIVEN Jeremy G. Frey cc: FutUndBeidl - https://www.flickr.com/photos/61423903@N06

  13. How do we communicate process? If you can't describe what you are doing as a process, you don't know what you're doing. W. Edwards Deming • Surprisingly difficult to explain what a process involves • Much of the detail is assumed to be understood and not explicitly discussed • This is where the miss-understandings usually arise. Jeremy G. Frey

  14. Ontology Jeremy G. Frey cc: Rich Anderson - https://www.flickr.com/photos/99105016@N00

  15. Others will do this first Not a good idea! Jeremy G. Frey

  16. FORWARD Jeremy G. Frey cc: `James Wheeler - https://www.flickr.com/photos/24128704@N08

  17. Priority Jeremy G. Frey cc: Robert S. Donovan - https://www.flickr.com/photos/10687935@N04

  18. COMMUNITY Jeremy G. Frey cc: quinn.anya - https://www.flickr.com/photos/53326337@N00

  19. Culture Jeremy G. Frey cc: jovike - https://www.flickr.com/photos/49503078599@N01

  20. strategy Jeremy G. Frey cc: horrigans - https://www.flickr.com/photos/8495857@N04

  21. We must speed up the knowledge discovery process All I am saying is that now is the time to develop the technology to deflect an asteroid Jeremy G. Frey

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