home/categories/computational-chemistry/gptomics-bioskills-metabolomics-metabolite-annotation-skill-md
computational-chemistryresearch
bio-metabolomics-metabolite-annotation
Metabolite identification from m/z and retention time. Covers database matching, MS/MS spectral matching, and confidence level assignment. Use when assigning compound identities to detected features in untargeted metabolomics.
maintainer
GPTomics
Обновлено 13.02.2026
Звёзды
471
Форки
81
quick start
Installation and usage
Metabolite identification from m/z and retention time. Covers database matching, MS/MS spectral matching, and confidence level assignment. Use when assigning compound identities to detected features in untargeted metabolomics.
Установка
$ install --globalskills.sh
Использование
После установки вы можете использовать этот skill, выполнив следующую команду в терминале:
skills use bio-metabolomics-metabolite-annotation