ResearchBenchmarksPhenotype-guided Molecular Generation on RCSB PDB and DTC Target: HDAC1Phenotype-guided Molecular Generation on RCSB PDB and DTC Target: HDAC1Follow-1.84AffinityTRIOMPHE-4.752-3.996-3.24-2.484Sep 25, 2025Evaluation resultsMethodMethodLinksAffinityQEDSATRIOMPHE2025.09-1.8443.74.3Pocket2Mol2025.09-2.350.5072.535SBDD-3D2025.09-2.830.6182.86SmilesGEN2025.09-3.5156.63.017SBMolGen2025.09-3.540.7132.95GxVAEs2025.09-3.5961.93.225XMolRL2025.09-4.6472.93.197XMolRL2025.09-4.640.7293.197