EuracBiomedicalResearch / lcms-standards

Measurements of standard compounds in LC/MS setups and configurations at Eurac Research
1 stars 0 forks source link

Some comments, updates and ideas #75

Closed jorainer closed 2 years ago

jorainer commented 2 years ago

This PR adds some updates/comments to the preprocessing-standards.Rmd . This PR adds also a new file match-standards-mix01.Rmd that defines a more "targeted" approach by first identifying for each standard all features which m/z matches the m/z of any possible adduct of the standard. This could possibly simplify the analysis as it reduces the complexity of the data set.