LTJv7 #83 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: Bictegravir
PA_A-H1N1

Docking Scores:
-10.75 -9.31 -10.06
Similarity Score:
N/A
Best Match:
N/A

L: Darunavir
PA_A-H1N1

Docking Scores:
-8.96 -7.71 -7.86
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PA_A-H1N1

Docking Scores:
-9.14 -8.92 -8.64
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PA_A-H1N1

Docking Scores:
-8.98 -9.63 -10.12
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PA_A-H1N1

Docking Scores:
-7.68 -6.96 -6.94
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PA_A-H5N1

Docking Scores:
-10.31 -10.27 -10.01
Similarity Score:
N/A
Best Match:
N/A

L: Darunavir
PA_A-H5N1

Docking Scores:
-7.77 -7.56 -7.85
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PA_A-H5N1

Docking Scores:
-9.68 -9.27 -9.37
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PA_A-H5N1

Docking Scores:
-10.31 -9.84 -10.35
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PA_A-H5N1

Docking Scores:
-6.92 -6.82 -6.90
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PA_INFA

Docking Scores:
-11.03 -9.40 -9.72
Similarity Score:
30.00%
Best Match:
CHEMBL2040578

L: Darunavir
PA_INFA

Docking Scores:
-8.61 -7.10 -7.84
Similarity Score:
28.70%
Best Match:
CHEMBL2040640

L: Baloxavir marboxil
PA_INFA

Docking Scores:
-8.72 -8.79 -9.05
Similarity Score:
26.71%
Best Match:
CHEMBL2040578

L: Simeprevir
PA_INFA

Docking Scores:
-10.09 -9.25 -9.77
Similarity Score:
32.87%
Best Match:
CHEMBL2040640

L: Adefovir dipivoxil
PA_INFA

Docking Scores:
-7.44 -6.83 -7.16
Similarity Score:
17.52%
Best Match:
CHEMBL2040578

L: Bictegravir
PA_INFB

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

L: Darunavir
PA_INFB

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

L: Baloxavir marboxil
PA_INFB

Docking Scores:
-8.34
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PA_INFB

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

L: Adefovir dipivoxil
PA_INFB

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