Yixuan's drug11-virus-ckb2 #373 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Remdesivir
NS5_ZIKV

Docking Scores:
-8.63 -5.71
Similarity Score:
N/A
Best Match:
N/A

L: Telaprevir
NS5_ZIKV

Docking Scores:
-8.37 -5.90
Similarity Score:
N/A
Best Match:
N/A

L: Boceprevir
NS5_ZIKV

Docking Scores:
-7.87 -5.44
Similarity Score:
N/A
Best Match:
N/A

L: Narlaprevir
NS5_ZIKV

Docking Scores:
-8.60 -5.53
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NS5_ZIKVF

Docking Scores:
-8.10
Similarity Score:
N/A
Best Match:
N/A

L: Telaprevir
NS5_ZIKVF

Docking Scores:
-8.42
Similarity Score:
N/A
Best Match:
N/A

L: Boceprevir
NS5_ZIKVF

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

L: Narlaprevir
NS5_ZIKVF

Docking Scores:
-8.97
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NS6_9CALI

Docking Scores:
-4.74 -6.05 -6.50
Similarity Score:
N/A
Best Match:
N/A

L: Telaprevir
NS6_9CALI

Docking Scores:
-5.54 -6.04 -6.94
Similarity Score:
N/A
Best Match:
N/A

L: Boceprevir
NS6_9CALI

Docking Scores:
-5.00 -5.67 -6.01
Similarity Score:
N/A
Best Match:
N/A

L: Narlaprevir
NS6_9CALI

Docking Scores:
-5.19 -4.95 -6.63
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
NSP15_SARS

Docking Scores:
-6.95
Similarity Score:
18.75%
Best Match:
CHEMBL2441745

L: Telaprevir
NSP15_SARS

Docking Scores:
-6.91
Similarity Score:
39.29%
Best Match:
CHEMBL2441745

L: Boceprevir
NSP15_SARS

Docking Scores:
-6.51
Similarity Score:
45.52%
Best Match:
CHEMBL2441745

L: Narlaprevir
NSP15_SARS

Docking Scores:
-6.17
Similarity Score:
39.16%
Best Match:
CHEMBL2441745

L: Remdesivir
NSP15_SARS2

Docking Scores:
-6.47
Similarity Score:
N/A
Best Match:
N/A

L: Telaprevir
NSP15_SARS2

Docking Scores:
-7.27
Similarity Score:
N/A
Best Match:
N/A

L: Boceprevir
NSP15_SARS2

Docking Scores:
-7.16
Similarity Score:
N/A
Best Match:
N/A

L: Narlaprevir
NSP15_SARS2

Docking Scores:
-6.56
Similarity Score:
N/A
Best Match:
N/A