Hopomics: Humulus lupulus brewing cultivars classification based on LC-MS profiling and nested feature selection.
R script may be used for fully data processing from raw data to peak table, including peak integration & alignment, QC-XGB signal correction and nested feature selection.
Yuriy A. Ikhalaynen, et al. "Hopomics of Humulus lupulus brewing cultivars for hops classification based on LC-MS profiling and nested feature selection" coming soon
MassIVE: MSV000089747
Corresponding dataset contains two types of files: whole set of LC-HRMS profiling from IT-TOF, and raw data from Orbitrap with MS2 fragmentation.
Please send any comment, suggestion or question you may have to the author (Mr. Yuriy Ikhalaynen), email: [email protected].