I used the official code and it ran successfully, but it didn't work when I switched to the cdf file I used for my experiment.
Earlier I asked the developers at xcms that they might have some problems with xcmsSet, so I'm not sure it's me now.
The problem with the cdf file is still a problem with the IPO package or there is still a problem with xcms.
The following is my error message:
Error in resultIncreased(history) :
No isotopes have been detected, peak picking not optimizable by IPO!Timing stopped at: 2313 1112 647.5
> traceback()
4: stop(paste("No isotopes have been detected,", "peak picking not optimizable by IPO!"))
3: resultIncreased(history)
2: optimizeXcmsSet(files = datafiles, params = peakpickingParameters,
nSlaves = 1, subdir = NULL, plot = F) at #2
1: system.time({
resultPeakpicking <- optimizeXcmsSet(files = datafiles, params = peakpickingParameters,
nSlaves = 1, subdir = NULL, plot = F)
})
I used the official code and it ran successfully, but it didn't work when I switched to the cdf file I used for my experiment. Earlier I asked the developers at
xcms
that they might have some problems withxcmsSet
, so I'm not sure it's me now. The problem with the cdf file is still a problem with theIPO
package or there is still a problem withxcms
. The following is my error message: