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Single-objective binding affinity optimization on ACAA1

0.037Best KD (1st Lowest)LPT-SGDS
-14.7615285.12849185.0185284.90851Oct 5, 2023

Evaluation results

MethodLinks
LPT-SGDS2023.100.0370.0460.084
LEBM-SGDS2023.100.110.110.12
LIMO2023.10373741
GCPN2023.10758384
GraphDF2023.10163203236
MolDQN2023.10240337608
MARS2023.10370520590