Re: Contributing to CHEMINF

[Michel Dumontier]

Hi Ola!

  Nice to see you on the list - looking forward to your contributions!  It would be great if you could periodically send an update to the list to say what's been added :)

Cheers,

m.

On Fri, Nov 18, 2011 at 1:35 PM, Ola Spjuth <ola.s...@gmail.com> wrote:

Dear all,

My name is Ola Spjuth and I have previously worked with Egon on BODO and the Bioclipse QSAR plugin [1], making use of the BODO for descriptor calculation. My plan is now to assist Egon with migrating BODO and CDK implementations to CHEMINF, and upgrade Bioclipse-QSAR to use CHEMINF instead of BODO. In the longer run I am also interested in extending CHEMINF with protein descriptors, and upgrade Bioclipse [2] to work with this to allow for Proteochemometrics modeling [3].

Today Egon got me started and I was able to add my first entry from BODO in CHEMINF; Egon set me up with write permissions so this has now been committed.

I just wanted to write some lines to introduce myself. Looking forward to further interactions.

Kind regards,

Ola Spjuth

[1] http://www.jcheminf.com/content/2/1/5

[2] http://www.biomedcentral.com/1471-2105/8/59

[3] http://molpharm.aspetjournals.org/content/61/6/1465.long

--
Michel Dumontier
Associate Professor of Bioinformatics
Carleton University
http://dumontierlab.com

[Egon Willighagen]

On Fri, Nov 18, 2011 at 7:40 PM, Michel Dumontier
<michel.d...@gmail.com> wrote:
> It would be great if you could periodically send an update to the list to say
> what's been added :)

You can also monitor that here:

http://code.google.com/p/semanticchemistry/source/list

Egon

--
Dr E.L. Willighagen
Postdoctoral Researcher
Institutet för miljömedicin
Karolinska Institutet (http://ki.se/imm)
Homepage: http://egonw.github.com/
LinkedIn: http://se.linkedin.com/in/egonw
Blog: http://chem-bla-ics.blogspot.com/
PubList: http://www.citeulike.org/user/egonw/tag/papers

[Janna Hastings]

Welcome on board Ola, and thanks very much for your contributions!
Janna