Metabolomics Society Forum

Software => XCMS => R => XCMS - FAQ => Topic started by: ab123 on October 21, 2017, 10:48:00 AM

Title: Outliers
Post by: ab123 on October 21, 2017, 10:48:00 AM
Quick question: if I get an outlier sample, should I rerun all preprocessing steps in xcms (ie. group, retcor etc.)?

I'm using retcor with orbitrap and profstep=0.1 so the process is currently using the outlier sample as a center sample...suffice to say I'm wondering if that means retention time correction has to be repeated?

Thanks!
Title: Re: Outliers
Post by: Jan Stanstrup on October 21, 2017, 10:59:53 AM
Depends why it is an outlier. RT shifts or just very different intensities? If the first it could make sense. If not then no I would say. If no shift but unique features pruning those features from the peaktable might be fine.