Fig. 3: HiTEA analysis of the Buchwald–Hartwig dataset.
From: Probing the chemical ‘reactome’ with high-throughput experimentation data
HiTEA/literature-specific variable importances agreement between the literature and HiTEA variable importances is highlighted. Acronym structures can be found in in Supplementary Fig. 11. Temp, reaction temperature. a, Variable importances are shown and unless otherwise specified, the metal source for the ligand is Pd(OAc)2. Where appropriate, reactant importances are shown. b, Statistically significant best-/worst-in-class catalysts and reagents are shown and unless otherwise specified, CuI is the copper source for the Ullmann couplings.
