[Orechem] chemistry extraction from supplemental data

Peter Murray-Rust pm286 at cam.ac.uk
Fri Mar 20 14:52:35 EDT 2009


2009/3/20 WILLIAM J BROUWER <wjb19 at psu.edu>

> Hi All;
>
> I've taken the chemistry extraction from supplemental data about as far as
> I can, without being privy to the data model. All the details and files are
> here -> http://services.nsdl.org/trac/oreChem/wiki/ChemistryDataExtraction
>

Thanks will look tomorroww

>
>
> I'm narrowing in on some permanent positions, so sadly I will have to sign
> off from oreChem... It's been a real pleasure getting to meet & work with
> you, particularly Peter. Good luck with the rest of the project and please
> don't hesitate
> to email me with any questions, I know my shell scripts read like Joyce
>

Thanks for your help. I certainly will mail if required

>
>
> all the best,
>
> bill brouwer
> (penn state chem)
>
>
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>
>


-- 
Peter Murray-Rust
Reader in Molecular Informatics
Unilever Centre, Dep. Of Chemistry
University of Cambridge
CB2 1EW, UK
+44-1223-763069
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