To cite chemodiv in publications use:

Hampus Petrén, Tobias G. Köllner, Robert R. Junker (2023). Quantifying chemodiversity considering biochemical and structural properties of compounds with the R package chemodiv. New Phytologist 237: 2478-2492.

Corresponding BibTeX entry:

  @Article{,
    title = {Quantifying chemodiversity considering biochemical and
      structural properties of compounds with the R package chemodiv},
    author = {Hampus Petrén and Tobias G. Köllner and Robert R.
      Junker},
    journal = {New Phytologist},
    year = {2023},
    volume = {237},
    number = {6},
    pages = {2478-2492},
  }