Checking, Curating And Qualifying Chemistry
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An overview of what we do to curate and annotate small molecules and how it's the basis of Chemmantis. A presentation given to the PDB team at Rutgers University
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Checking, Curating And Qualifying Chemistry
- 1. Checking, Curating and Qualifying Chemistry to Build a Structure Centric Community for Chemists Rutgers University 12/2/2008 Antony Williams
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- 8. Link outs
- 9. Links out to KEGG Kyoto Encyclopedia of Genes and Genomes
- 10. How many names does a compound have?
- 12. Complex Search
- 14. Quality is a Major Issue- Search Butanol OLD EXAMPLE..now fixed
- 17. Other issues…
- 18. Charges
- 19. Sugars – Machine Readable vs Aesthetics Haworth Stereo Fischer
- 20. Wikipedia – Crowdsourcing Chemistry
- 24. Multi-level Curation and Approval
- 27. “ Collaboration” with ChEBI
- 28. Ginkgolide B
- 29. DailyMed
- 37. Document markup
- 38. Markup – 3 seconds!
- 39. On the fly conversion
- 41. One Click to more Info…
- 43. Ambiguity
- 44. Ambiguity in Abbreviations - DPA
- 46. Patents
- 51. Integrations Out to Other Sources
- 52. Reactions