ResearchBenchmarksUnconditional Molecule Generation on QM9 implicit hydrogens (test)Follow100ValidityEDM96.67297.53698.499.264Feb 17, 2023Evaluation ResultsMethodMethodLinksValidityUniquenessNoveltyConnectednessValency Error (e-2)Atom Count Error (e-2)Bond Count Error (e-2)Bond Length Error (e-2 Å)EDMRefinement=OBabelRefinement=OBabel2023.0210096.145.499.93.82.90.30.2MiDischedule=adaptiveschedule=adaptive2023.0299.793.944.71005.911.71.11.6Data2023.0299.599.9—1000.60.10.10.3MiDischedule=uniformschedule=uniform2023.0299.595.849.21002.33.10.40.8EDM2023.0296.896.645.599.94.32.90.90.2