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. 2023 Mar 28;15:38. doi: 10.1186/s13321-023-00702-2

Table 1.

Mean values of three metrics (docking score, QED, and SAscore) on generation quality of DRD2

Metric(Mean Value) This Work Real
Docking Score (kcal/mol, ↓)  − 8.8904  − 7.7532
QED (↑) 0.6402 0.6016
SAscore (↑) 3.0755 2.6886

(↑) means higher is better, and (↓) means lower is better