Psp case study #507 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Remdesivir
G1_ADNV

Docking Scores:
-3.51 -6.28 -6.09
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
G1_ADNV

Docking Scores:
18.64 -4.31 -4.03
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
G2_ADNV

Docking Scores:
-8.15 -8.04 -6.86
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
G2_ADNV

Docking Scores:
-6.02 -4.21 24.40
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
GB_HHV11

Docking Scores:
-7.02
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
GB_HHV11

Docking Scores:
-5.52
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
GB_HHV1K

Docking Scores:
-6.80 -6.73
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
GB_HHV1K

Docking Scores:
? ?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
GD_9ALPH

Docking Scores:
-7.13 -6.74
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
GD_9ALPH

Docking Scores:
? ?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
GD_HHV1

Docking Scores:
-5.96
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
GD_HHV1

Docking Scores:
-5.77
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
GP160_HIV1

Docking Scores:
-7.91 -7.78 -7.56
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
GP160_HIV1

Docking Scores:
? ? ?
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
GP160_HIV2

Docking Scores:
-6.96
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
GP160_HIV2

Docking Scores:
-4.94
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir
GP_EBOV

Docking Scores:
-7.51 -6.70 -7.79
Similarity Score:
26.79%
Best Match:
CHEMBL3125895

L: Remdesivir triphosphate
GP_EBOV

Docking Scores:
-5.64 22.93 5.64
Similarity Score:
23.18%
Best Match:
CHEMBL3125895

L: Remdesivir
GP_LASSJ

Docking Scores:
-5.35 -6.05
Similarity Score:
N/A
Best Match:
N/A

L: Remdesivir triphosphate
GP_LASSJ

Docking Scores:
? ?
Similarity Score:
N/A
Best Match:
N/A