[OTDev] R interface for OpenTox services
Om ompandey at gmail.comFri Oct 29 14:26:10 CEST 2010
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On Fri, Oct 29, 2010 at 5:24 PM, Nina Jeliazkova <jeliazkova.nina at gmail.com>wrote: > On 29 October 2010 14:35, Egon Willighagen <egon.willighagen at gmail.com > >wrote: > > > On Fri, Oct 29, 2010 at 1:33 PM, Nina Jeliazkova > > <jeliazkova.nina at gmail.com> wrote: > > > On 29 October 2010 14:00, Christoph Helma <helma at in-silico.ch> wrote: > > >> I have talked at the final Sensitiv meeting with a Bioinformatician > who > > >> would be interested in using OpenTox services from R. I am sure that > > >> this is possible, but it would require some efforts to map R's > > >> datastructures (data frames, ...) to OpenTox datasets. Unfortunatly I > > >> cannot devote much time to this - are there any volunteers? > > > > > > We were just discussing similar idea this week. We've started quite > > recently > > > to explore R . Data frames seem to have similar table (row/columns) > > > structure to OpenTox datasets, and it is possible to call Java code > from > > R, > > > so it should be feasible to have OpenTox client written in Java and > call > > it > > > from R. > > > > Chemistry handling can be done with Rajarshi's rcdk... > > > > > Yes. > > I was actually thinking of a simple client to call services and chemistry > is > mostly done internally by the services. BTW, is there anything like "curl" > one can call from R ? > There is package called RCurl. http://www.omegahat.org/RCurl/ Thanks om > > Nina > > > > Egon > > > > > > -- > > Dr E.L. Willighagen > > Postdoctoral Research Associate > > University of Cambridge > > 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 > > _______________________________________________ > > Development mailing list > > Development at opentox.org > > http://www.opentox.org/mailman/listinfo/development > > > _______________________________________________ > Development mailing list > Development at opentox.org > http://www.opentox.org/mailman/listinfo/development >
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