"cliqueMS" annotates processed LC/MZ data. This R package obtains annotation for isotopes, ion adducts and fragmentation adducts. The adducts list can be supplied by the user or either use one of the package's lists.
Installation has been tested on Linux, Windows and macOS.
You can install "cliqueMS" from github with:
# install.packages("devtools") devtools::install_github("osenan/cliqueMS")
Also, you can install it from CRAN with:
Usage and examples
For a tutorial on "cliqueMS" please check the vignette: