Molecular Optimization on PMO benchmark leaderboard · SOTA2 Research

Molecular Optimization on PMO

0.98Albuterol Similarityf-RAG

Evaluation Results

Method	Links
f-RAG2026.06		0.98	0.75	0.78	0.94	0.99	0.86	0.97	0.96	0.87	0.7	0.34	0.32	0.67	0.87	0.68	0.94	0.82	0.58	0.6	0.58	0.45	0.63	0.49	16.93
GenMol2026.06		0.94	0.81	0.83	0.96	1	0.9	0.99	0.94	0.83	0.91	0.4	0.4	0.98	0.88	0.72	0.94	0.82	0.63	0.59	0.7	0.87	0.82	0.58	18.36
Genetic GFN2026.06		0.94	0.67	0.77	0.68	0.97	0.83	0.88	0.97	0.89	0.71	0.35	0.27	0.76	0.85	0.59	0.95	0.78	0.56	0.64	0.58	0.51	0.12	0.54	15.81
Genetic GFN2026.06		0.92	0.68	0.58	0.63	0.97	0.8	0.79	0.98	0.89	0.57	0.34	0.27	0.75	0.84	0.57	0.94	0.77	0.6	0.42	0.65	0.53	0	0.49	14.97
molGA2026.06		0.9	0.69	0.57	0.65	0.94	0.83	0.84	0.88	0.87	0.78	0.26	0.3	0.6	0.84	0.55	0.94	0.8	0.53	0.58	0.52	0.43	0	0.52	14.71
Genetic GFN2026.06		0.9	0.56	0.68	0.65	0.96	0.79	0.8	0.98	0.83	0.62	0.28	0.32	0.84	0.85	0.56	0.94	0.79	0.56	0.5	0.4	0.41	0	0.49	14.7
Genetic GFN2026.06		0.89	0.6	0.59	0.78	0.96	0.77	0.86	0.98	0.81	0.66	0.32	0.33	0.85	0.87	0.58	0.94	0.77	0.58	0.48	0.45	0.42	0.1	0.53	15.11
REINVENT2026.06		0.88	0.64	0.71	0.67	0.95	0.78	0.87	0.85	0.64	0.78	0.36	0.28	0.62	0.84	0.54	0.94	0.76	0.56	0.02	0.53	0.44	0.18	0.36	14.2
Genetic GFN2026.06		0.87	0.58	0.71	0.7	0.96	0.79	0.83	0.97	0.78	0.66	0.28	0.32	0.86	0.86	0.55	0.94	0.79	0.59	0.45	0.44	0.39	0.05	0.5	14.9
Genetic GFN2026.06		0.84	0.58	0.6	0.65	0.96	0.78	0.83	0.98	0.82	0.65	0.3	0.33	0.85	0.86	0.56	0.94	0.79	0.59	0.46	0.44	0.39	0.03	0.51	14.75