R 2.12.0
rcdk_3.0.5 I got it from CRAN
even by calling "cdk.version"
function ()
{
.jcall("org.openscience.cdk.CDK", "S", "getVersion")
}
On Mon, Jan 10, 2011 at 11:17 PM, Rajarshi Guha <rajarshi.g...@gmail.com>wrote:
> What version of R and rcdk are you using?
>
> On Mon, Jan 10, 2011 at 2:01 PM, Alireza Kashani
> <alireza.kashanip...@gmail.com> wrote:
> > Hi there,
> >
> > I have just installed the last version of rcdk package on our server.
> > I pasted what I tried;
> >
> >> ? parse.smiles
> >> smiles <- c('CCC', 'c1ccccc1', 'C(C)(C=O)C(CCNC)C1CC1C(=O)')
> >> mol <- parse.smiles(smiles[1])
> >
> > and the ERROR !
> >
> > Error in .jcall("org/openscience/cdk/DefaultChemObjectBuilder",
> > "Lorg/openscience/cdk/interfaces/IChemObjectBuilder;", :
> > RcallMethod: cannot determine object class
> >
> > Any idea ?!
> >
> >
> > Alireza
> >
> >
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>
>
>
> --
> Rajarshi Guha
> NIH Chemical Genomics Center
>
------------------------------------------------------------------------------
Gaining the trust of online customers is vital for the success of any company
that requires sensitive data to be transmitted over the Web. Learn how to
best implement a security strategy that keeps consumers' information secure
and instills the confidence they need to proceed with transactions.
http://p.sf.net/sfu/oracle-sfdevnl
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