ResearchBenchmarksUnconditional molecule generation on MOSES SF (test)Unconditional molecule generation on MOSES SF (test)Follow100ValidityJT-VAE85.12888.98992.8596.711Feb 18, 2026Evaluation resultsMethodMethodLinksValidityUniquenessNoveltyStructural Filters Pass RateFCDSNN SimilarityScaffold SimilarityJT-VAE2026.0210010099.997.881.80.5310MOLER2026.0210099.997.1—85.2——NSGGM2026.0210010094.497.182.30.511.2GraphINVENT2026.0296.499.8—9578.30.5412.7DISCO-GT2026.0288.310097.795.674.90.515.1DiGRESS2026.0285.71009597.178.80.5214.8