To cite MetaboAnnotatoR in publications use:

  Graca G, Lau C, Vorkas P, Lewis M, Want E, Herrington D, Ebbels T
  (2022). “Automated annotation of untargeted all-ion fragmentation
  LC-MS metabolomics data with MetaboAnnotatoR.” _Analytical
  Chemistry_, *94*(8), 3446-3455. doi:10.1021/acs.analchem.1c03032
  <https://doi.org/10.1021/acs.analchem.1c03032>.

A BibTeX entry for LaTeX users is

  @Article{,
    title = {Automated annotation of untargeted all-ion fragmentation LC-MS metabolomics data with MetaboAnnotatoR},
    author = {Goncalo Graca and Chung-Ho E. Lau and Panagiotis A. Vorkas and Matthew R. Lewis and Elizabeth J. Want and David Herrington and Timothy M. D. Ebbels},
    journal = {Analytical Chemistry},
    year = {2022},
    volume = {94},
    number = {8},
    pages = {3446-3455},
    doi = {10.1021/acs.analchem.1c03032},
  }