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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