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Molecular Optimization on GuacaMol

0.242Median Score 1

Graph MCTS

Updated 4d ago

Evaluation Results

Method	Links
Graph MCTS 2026.01		0.242	0.148	0.334	0.738	0.483	0.21	0.166	0	0.369	0.611	3.301	25
GFlowNet 2026.01		0.237	0.198	0.478	0.817	0.482	0.045	0.118	0	0.701	0.727	3.803	23
GFlowNet-AL 2026.01		0.229	0.191	0.464	0.812	0.466	0.028	0.048	0	0.705	0.732	3.675	24
Pasithea 2026.01		0.216	0.194	0.447	0.792	0.585	0.23	0.243	0.064	0.443	0.707	3.921	21
JT-VAE BO 2026.01		0.212	0.192	0.463	0.8	0.585	0.169	0.302	0	0.587	0.702	4.012	20
DoG-AE 2026.01		0.203	0.201	0.464	0.793	0.539	0.039	0.156	0	0.744	0.723	3.862	22
MolDQN 2026.01		0.188	0.108	0.282	0.699	0.383	0.015	0.042	0	0.171	0.532	2.42	26