Critical Assessment of Small Molecule Identification 2016: automated methods.
Emma SchymanskiChristoph RuttkiesMartin KraussCéline BrouardTobias KindKai DührkopFelicity AllenArpana VaniyaDries VerdegemSebastian BöckerJuho RousuHuibin ShenHiroshi TsugawaTanvir SajedOliver FiehnBart GhesquièreSteffen NeumannPublished in: J. Cheminformatics (2017)