LTJv14 #90 Output Download CSV

View All
 
  The docking scores are in the AutoDock Vina metric.
L: Elvitegravir
PA_A-H1N1

Docking Scores:
-7.82 -7.76 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: Daclatasvir
PA_A-H1N1

Docking Scores:
-8.38 -8.44 -8.61
Similarity Score:
N/A
Best Match:
N/A

L: Amantadine
PA_A-H1N1

Docking Scores:
-4.92 -4.68 -5.03
Similarity Score:
N/A
Best Match:
N/A

L: Ritonavir
PA_A-H1N1

Docking Scores:
-8.90 -8.39 -8.29
Similarity Score:
N/A
Best Match:
N/A

L: Tenofovir alafenamide
PA_A-H1N1

Docking Scores:
-7.73 -7.49 -7.52
Similarity Score:
N/A
Best Match:
N/A

L: Elvitegravir
PA_A-H5N1

Docking Scores:
-8.41 -8.08 -7.99
Similarity Score:
N/A
Best Match:
N/A

L: Daclatasvir
PA_A-H5N1

Docking Scores:
-8.91 -7.79 -8.63
Similarity Score:
N/A
Best Match:
N/A

L: Amantadine
PA_A-H5N1

Docking Scores:
-5.10 -4.84 -4.90
Similarity Score:
N/A
Best Match:
N/A

L: Ritonavir
PA_A-H5N1

Docking Scores:
-8.45 -8.39 -7.69
Similarity Score:
N/A
Best Match:
N/A

L: Tenofovir alafenamide
PA_A-H5N1

Docking Scores:
-7.56 -7.29 -7.95
Similarity Score:
N/A
Best Match:
N/A

L: Elvitegravir
PA_INFA

Docking Scores:
-7.91 -8.05 -7.84
Similarity Score:
28.31%
Best Match:
CHEMBL3600947

L: Daclatasvir
PA_INFA

Docking Scores:
-8.63 -8.90 -7.91
Similarity Score:
28.38%
Best Match:
CHEMBL2040569

L: Amantadine
PA_INFA

Docking Scores:
-4.80 -4.87 -4.94
Similarity Score:
14.77%
Best Match:
CHEMBL2040554

L: Ritonavir
PA_INFA

Docking Scores:
-8.63 -7.88 -7.61
Similarity Score:
28.68%
Best Match:
CHEMBL2040640

L: Tenofovir alafenamide
PA_INFA

Docking Scores:
-8.14 -6.95 -7.67
Similarity Score:
15.56%
Best Match:
CHEMBL2040578

L: Elvitegravir
PA_INFB

Docking Scores:
-7.70
Similarity Score:
N/A
Best Match:
N/A

L: Daclatasvir
PA_INFB

Docking Scores:
-7.74
Similarity Score:
N/A
Best Match:
N/A

L: Amantadine
PA_INFB

Docking Scores:
-4.63
Similarity Score:
N/A
Best Match:
N/A

L: Ritonavir
PA_INFB

Docking Scores:
-7.47
Similarity Score:
N/A
Best Match:
N/A

L: Tenofovir alafenamide
PA_INFB

Docking Scores:
-7.52
Similarity Score:
N/A
Best Match:
N/A