prepare_annotations_spectra: Prepare annotations MS2

In taxonomicallyinformedannotation/tima-r: Taxonomically Informed Metabolite Annotation

Prepare annotations MS2

Description

This function prepares the spectral matches obtained previously to make them compatible

Usage

prepare_annotations_spectra(
  input = get_params(step =
    "prepare_annotations_spectra")$files$annotations$raw$spectral$spectral,
  output = get_params(step =
    "prepare_annotations_spectra")$files$annotations$prepared$structural$spectral,
  str_stereo = get_params(step =
    "prepare_annotations_spectra")$files$libraries$sop$merged$structures$stereo,
  str_met = get_params(step =
    "prepare_annotations_spectra")$files$libraries$sop$merged$structures$metadata,
  str_nam = get_params(step =
    "prepare_annotations_spectra")$files$libraries$sop$merged$structures$names,
  str_tax_cla = get_params(step =
    "prepare_annotations_spectra")$files$libraries$sop$merged$structures$taxonomies$cla,
  str_tax_npc = get_params(step =
    "prepare_annotations_spectra")$files$libraries$sop$merged$structures$taxonomies$npc
)

Arguments

input	Input file
output	Output file
str_stereo	File containing structures stereo
str_met	File containing structures metadata
str_nam	File containing structures names
str_tax_cla	File containing Classyfire taxonomy
str_tax_npc	File containing NPClassifier taxonomy

Examples

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taxonomicallyinformedannotation/tima-r documentation built on July 17, 2024, 7:11 p.m.