But the outcome is pretty awesome: the Markdown is linked to a BibTeX file, and citing articles in the Markdown is done by adding something like @somePaper, where 'somePaper' is the BibTeX key. And if you want to add CiTO intention annotation, you would prefix the key with the intention, like @uses_method_in:somePaper. And for the Journal of Cheminformatics template automatically put the intention in the reference list, like below:
Finally, a huge thanks to Albert Krewinkel for writing the Lua plugins for Pandoc to make this working! Next stop is RStudio rticles support.

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