Case-8.29.23 #513 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Remdesivir
2A_HE71

Docking Scores:
-7.89
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
2A_HE71

Docking Scores:
-7.20
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
2A_HE71M

Docking Scores:
-7.64
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
2A_HE71M

Docking Scores:
-6.87
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
2C_HE71

Docking Scores:
-5.30 -6.54
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
2C_HE71

Docking Scores:
-5.55 -6.93
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
3A_9ENTO

Docking Scores:
-5.68
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
3A_9ENTO

Docking Scores:
-5.05
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
3A_HE71M

Docking Scores:
-5.58
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
3A_HE71M

Docking Scores:
-4.97
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
3A_HED68

Docking Scores:
-5.30
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
3A_HED68

Docking Scores:
-5.74
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
3C_HE71

Docking Scores:
-5.70 -7.11
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
3C_HE71

Docking Scores:
-6.02 -6.00
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
3C_HED68

Docking Scores:
-6.39
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
3C_HED68

Docking Scores:
-5.75
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
3D_HE71

Docking Scores:
-7.03
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
3D_HE71

Docking Scores:
-7.11
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
3D_HED68

Docking Scores:
-7.95
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir Triphosphate
3D_HED68

Docking Scores:
-8.15
Similarity Score:
N/A
Best Match:
N/A