LTJv12 #88 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Saquinavir
PA_A-H1N1

Docking Scores:
-10.93 -9.72 -9.35
Similarity Score:
N/A
Best Match:
N/A

L: Valganciclovir
PA_A-H1N1

Docking Scores:
-6.56 -7.10 -7.00
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PA_A-H1N1

Docking Scores:
-9.75 -7.94 -8.32
Similarity Score:
N/A
Best Match:
N/A

L: Rilpivirine
PA_A-H1N1

Docking Scores:
-8.41 -8.21 -8.48
Similarity Score:
N/A
Best Match:
N/A

L: Foscarnet
PA_A-H1N1

Docking Scores:
-4.08 -4.37 -3.95
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PA_A-H5N1

Docking Scores:
-9.73 -9.86 -9.93
Similarity Score:
N/A
Best Match:
N/A

L: Valganciclovir
PA_A-H5N1

Docking Scores:
-6.44 -6.90 -7.03
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PA_A-H5N1

Docking Scores:
-8.44 -8.67 -8.28
Similarity Score:
N/A
Best Match:
N/A

L: Rilpivirine
PA_A-H5N1

Docking Scores:
-8.29 -7.63 -8.51
Similarity Score:
N/A
Best Match:
N/A

L: Foscarnet
PA_A-H5N1

Docking Scores:
-4.11 -4.04 -3.94
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PA_INFA

Docking Scores:
-9.22 -8.55 -9.56
Similarity Score:
35.43%
Best Match:
CHEMBL463590

L: Valganciclovir
PA_INFA

Docking Scores:
-7.35 -6.55 -6.83
Similarity Score:
24.66%
Best Match:
CHEMBL2040578

L: Nelfinavir
PA_INFA

Docking Scores:
-9.38 -7.95 -9.44
Similarity Score:
28.57%
Best Match:
CHEMBL278402

L: Rilpivirine
PA_INFA

Docking Scores:
-9.20 -7.32 -8.25
Similarity Score:
24.38%
Best Match:
CHEMBL2040578

L: Foscarnet
PA_INFA

Docking Scores:
-3.96 -4.25 -4.57
Similarity Score:
6.85%
Best Match:
CHEMBL1829211

L: Saquinavir
PA_INFB

Docking Scores:
-9.27
Similarity Score:
N/A
Best Match:
N/A

L: Valganciclovir
PA_INFB

Docking Scores:
-6.11
Similarity Score:
N/A
Best Match:
N/A

L: Nelfinavir
PA_INFB

Docking Scores:
-8.87
Similarity Score:
N/A
Best Match:
N/A

L: Rilpivirine
PA_INFB

Docking Scores:
-8.28
Similarity Score:
N/A
Best Match:
N/A

L: Foscarnet
PA_INFB

Docking Scores:
-4.10
Similarity Score:
N/A
Best Match:
N/A