Enumeration of de novo inorganic complexes for chemical discovery and machine learningJan 1, 2020ยทStefan Gugler,Jon Paul Janet,Heather J Kulikยท 0 min read CiteTypeJournal articlePublicationMolecular Systems Design & EngineeringLast updated on Jan 1, 2020 ← qcscine/readuct: Release 3.0. 0 Jan 1, 2021Gaussian process-based refinement of dispersion corrections Jan 1, 2019 →