Thanks Paul,
I was trying to get the function for getMass to input into another column
into a data set using R code:
FakeCompounds$Molecule - with(FakeCompounds,
getMolecule(Molecular.Formula))
showData(FakeCompounds, placement='-20+200', font=getRcmdr('logFont'),
maxwidth=80,
Hi Paul! Thanks a lot!
I tried downloading the Rdisop file and encountered this error:
Error: package ‘Rdisop’ is not installed for 'arch=x64'
I tried downloading directly from the source using R and got this error:
Error in file(filename, r, encoding = encoding) :
cannot open the
I also tried downloading the JDK version of Java and received this new error
when running it:
Error : .onLoad failed in loadNamespace() for 'rJava', details:
call: dirname(this$RuntimeLib)
error: a character vector argument expected
Error: package/namespace load failed for ‘rJava’
--
View
Matthew,
My Fault I should have sent you to the current release cycle page. The link was
for the old 2.6 Bioconductor release, sorry about that. :(
Personally the easies way to install any bioconductor package is to open R copy
and paste the following code:
Matthew,
I would try first looking at the Rcdk package. From it sound like what you
want to do they already have some very efficient code to that. If you don't
want all of CDK then you could try Rdisop from Bioconductor. The package
will take a formula and give you it's mass. It won't do a
Hi!
Just started working at a lab and have only minimal experience with R.
I was wondering if there was a way to write a code that would intake a data
set of chemical compounds (ex: H2O, CH3)
and be able to give an output column of the molecular weight?
I tried some really basic coding to try
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