Rich Apodaca is using our services and, being Rich (and I mean that in a GOOD way!) he is being more demanding. He comments as shown below:

apodaca1.png

What is feasible at present? Here are some URLs …try them out

http://www.chemspider.com/Chemical-Structure/10470357.html

http://www.chemspider.com/InChIKey/DEIYFTQMQPDXOT-RERXVCSDCZ

http://www.chemspider.com/InChI/1/C22H30N6O4S.C6H8O7/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28;7-3(8)1-6(13,5(11)12)2-4(9)10/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

http://www.chemspider.com/image/16740650

http://www.chemspider.com/mol/16740650

http://www.chemspider.com/image/16740650.png

http://www.chemspider.com/mol/16740650.mol

Rich provides an example of a developer wanting to utilize the services in a certain way..as outlined below….

apodaca2.png

We’re doing what we can to satiate those needs… Rich, it’s nice to be appreciated. Thanks!

Stumble it!

5 Responses to “Helping the Cheminformatics Community Through Our Web Services”

  1. Helping the Cheminformatics Community Through Our Web Services says:

    [...] You can read the rest of this blog post by going to the original source, here [...]

  2. Egon Willighagen says:

    My hands are itching… let’s get http://rdf.chemspider.com/InChIKey/DEIYFTQMQPDXOT-RERXVCSDCZ going…

    I have set up preliminary supporting Class’s and Property’s for this kind of work for Strigi [1]. We can have this set up in a couple of days…

  3. Rich Apodaca says:

    Me… demanding? What ever gave you that idea? :-)

    Actually, this is great stuff.

    But…

    I’m not sure this fits w/ ChemSpider’s goals, so feel free to say so… I”d still like the url:

    http://www.chemspider.com/InChIKey/DEIYFTQMQPDXOT-RERXVCSDCZ

    and the others like it to point to the compound summary page – not to a query results page. If the encoded InChIKey is not on CS, then a 404 would be returned.

    Then, nesting CS resources (images, links, molfiles, etc.) for a molecule under it’s InChIKey URL would make it trivial to program ChemSpider.

  4. ChemSpider Blog » Blog Archive » Curators Perform Heroic Duties. They Should be Celebrated! says:

    [...] Instead we are doing great things for the community I hope. We have opened up a series of services that the Open Access world likes (specifically the Blue obelisk players..), we are donating our database to PubChem shortly, and we [...]

  5. Egon Willighagen says:

    What about http://www.chemspider.com/mol/InChI/1/CH4/h1H4 ?

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