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.
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: ikh.ya@yandex.ru.