Aseel2023 #477 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

2A_HE71

Docking Scores:
-8.35
Similarity Score:
N/A
Best Match:
N/A

2A_HE71M

Docking Scores:
-8.25
Similarity Score:
N/A
Best Match:
N/A

2C_HE71

Docking Scores:
-5.59 -6.69
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

Docking Scores:
-6.44
Similarity Score:
N/A
Best Match:
N/A

3A_HE71M

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

3A_HED68

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

3C_HE71

Docking Scores:
-6.77 -6.69
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

Docking Scores:
-5.99
Similarity Score:
N/A
Best Match:
N/A

3D_HE71

Docking Scores:
-7.71
Similarity Score:
N/A
Best Match:
N/A

3D_HED68

Docking Scores:
-8.36
Similarity Score:
N/A
Best Match:
N/A

ACE2_HUMAN

Docking Scores:
-9.47
Similarity Score:
27.49%
Best Match:
CHEMBL436639

CAPSD_9CALI

Docking Scores:
-8.07 -7.54 -7.49
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

Docking Scores:
-7.63
Similarity Score:
N/A
Best Match:
N/A

CAPSD_DEN2P

Docking Scores:
-7.51
Similarity Score:
N/A
Best Match:
N/A

CAPSD_HCV77

Docking Scores:
-5.27
Similarity Score:
33.89%
Best Match:
CHEMBL3984605

CAPSD_HED68

Docking Scores:
-8.37 -9.37
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.30 -7.08
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-6.86
Similarity Score:
25.77%
Best Match:
CHEMBL479371

E1_9HEPC

Docking Scores:
-5.84
Similarity Score:
N/A
Best Match:
N/A

E1_HCV77

Docking Scores:
-4.48
Similarity Score:
33.89%
Best Match:
CHEMBL3984605