Erratum to: The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching.
Egon L WilighagenJohn W MayfieldJonathan AlvarssonArvid BergLars CarlssonNina JeliazkovaStefan KuhnTomáš PluskalMiquel Rojas-ChertóOla SpjuthGilleain TorranceChris T A EveloRajarashi GuhaChristoph SteinbeckPublished in: Journal of cheminformatics (2017)