Implementations of the chemical structural and compositional similarity metric in R and Python
Asker Brejnrod, Madeleine Ernst, Piotr Dworzynski, Lasse Buur Rasmussen, Pieter C. Dorrestein, Justin J.J. van der Hooft, Manimozhiyan Arumugam
bioRxiv 546150; doi: https://doi.org/10.1101/546150