De Novo Drug Design on QED alpha=0.05
100Observed CoverageCoDrug (Energy)
Evaluation results
| Method | Links | |
|---|---|---|
| CoDrug (Energy)Generative Model=GraphGA, Target Label (Y)=12023.10 | 100 | |
| UnweightedGenerative Model=GraphGA, Target Label (Y)=12023.10 | 100 | |
| UnweightedGenerative Model=REINVENT, Target Label (Y)=12023.10 | 100 | |
| UnweightedGenerative Model=GraphGA, Target Label (Y)=12023.10 | 100 | |
| CoDrug (Energy)Generative Model=GraphGA, Target Label (Y)=12023.10 | 98 | |
| CoDrug (Energy)Generative Model=REINVENT, Target Label (Y)=02023.10 | 97 | |
| CoDrug (Energy)Generative Model=REINVENT, Target Label (Y)=12023.10 | 97 | |
| CoDrug (Energy)Generative Model=GraphGA, Target Label (Y)=02023.10 | 97 | |
| UnweightedGenerative Model=REINVENT, Target Label (Y)=12023.10 | 96 | |
| UnweightedGenerative Model=REINVENT, Target Label (Y)=02023.10 | 94 | |
| CoDrug (Energy)Generative Model=REINVENT, Target Label (Y)=12023.10 | 92 | |
| CoDrug (Energy)Generative Model=REINVENT, Target Label (Y)=02023.10 | 91 | |
| CoDrug (Energy)Generative Model=GraphGA, Target Label (Y)=02023.10 | 91 | |
| UnweightedGenerative Model=GraphGA, Target Label (Y)=02023.10 | 81 | |
| UnweightedGenerative Model=GraphGA, Target Label (Y)=02023.10 | 77 | |
| UnweightedGenerative Model=REINVENT, Target Label (Y)=02023.10 | 63 |