Difference between revisions of "Help:Useful chemistry sites"
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==Databases== | ==Databases== | ||
| + | *[http://depth-first.com/articles/2007/01/24/thirty-two-free-chemistry-databases Depth First list of free databases] | ||
*[http://www.webreactions.net/ WebReactions]: Searchable database of organic reactions | *[http://www.webreactions.net/ WebReactions]: Searchable database of organic reactions | ||
*[http://pubchem.ncbi.nlm.nih.gov/ PubChem]: Free government database of structures | *[http://pubchem.ncbi.nlm.nih.gov/ PubChem]: Free government database of structures | ||
Latest revision as of 02:09, 3 August 2007
Some useful chemistry sites:
Databases
- Depth First list of free databases
- WebReactions: Searchable database of organic reactions
- PubChem: Free government database of structures
- ChemSpider: 16+ million chemical structures
- NIST database: thermochemical info, IR, UV
- SDBS spectral database: NMR, IR
- NMRShiftDB: Open NMR database
- ChemRefer: Chemical literature, searchable full-text, open access
- ChemExper and eMolecules: Find sources of chemicals
- OrgSyn: Tested experimental procedures from Organic Syntheses
- ZINC: virtual screening
Literature
- G. L. Holliday, P. Murray-Rust, H. S. Rzepa, "Chemical Markup, XML and the Worldwide Web. Part 6. CMLReact; An XML Vocabulary for Chemical Reactions", J. Chem. Inf. Mod., 2006, 46, 145-157. DOI:10.1021/ci0502698 [1]
