swissLipidsAdvancedSearch: SwissLipids API advanced search function
In michaelwitting/SwissLipidsR: R access to the SwissLipids API

Description Usage Arguments Value Author(s) Examples

View source: R/search.R

'swissLipidsAdvancedSearch' Performs an advanced search using the SwissLipids API

swissLipidsAdvancedSearch(
  name = NA_character_,
  smiles = NA_character_,
  inchikey = NA_character_,
  formula = NA_character_,
  mz = NA_real_,
  adduct = NA_character_,
  massErrorRate = NA_real_
)

`name`	'character'
`smiles`	'character'
`inchikey`	'character'
`formula`	'character'
`mz`	'numeric'
`adduct`	'character'
`massErrorRate`	'numeric'

'data.frame' A named list with the search results

Michael Witting#'

swissLipidsAdvancedSearch(name = "PC(34:2)")
swissLipidsAdvancedSearch(formula = "C39H76NO8P")

swissLipidsAdvancedSearch(mz = 410.243, adduct = "MassExact", massErrorRate = 0.001)