add_smiles {autonomics} | R Documentation |
Add smiles
add_smiles(object)
object |
character/factor vector with pubchem ids |
character/factor vector
https://pubchemdocs.ncbi.nlm.nih.gov/pug-rest-tutorial
file <- download_data('atkin18.metabolon.xlsx') object <- read_metabolon(file, plot=FALSE) add_smiles(object[1:10, ])