RG2_VIRAL_2 #288 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: MOLECULE 127
PA_A-H17N10

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

L: MOLECULE 25
PA_A-H17N10

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

L: MOLECULE 78
PA_A-H17N10

Docking Scores:
-8.70
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 177
PA_A-H17N10

Docking Scores:
-10.18
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 20
PA_A-H17N10

Docking Scores:
-6.27
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 127
PA_A-H1N1

Docking Scores:
-8.64 -7.48 -7.69
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 25
PA_A-H1N1

Docking Scores:
-9.29 -8.19 -9.64
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 78
PA_A-H1N1

Docking Scores:
-9.64 -9.08 -9.38
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 177
PA_A-H1N1

Docking Scores:
-11.07 -11.33 -12.09
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 20
PA_A-H1N1

Docking Scores:
-8.77 -7.52 -8.99
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 127
PA_A-H5N1

Docking Scores:
36.71 ? ?
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 25
PA_A-H5N1

Docking Scores:
-3.69 -6.15 -7.73
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 78
PA_A-H5N1

Docking Scores:
-9.81 -10.38 -10.43
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 177
PA_A-H5N1

Docking Scores:
-11.56 -10.46 -11.44
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 20
PA_A-H5N1

Docking Scores:
-6.66 -5.29 -9.76
Similarity Score:
N/A
Best Match:
N/A

L: MOLECULE 127
PA_INFA

Docking Scores:
-7.20 -6.58 17.18
Similarity Score:
19.69%
Best Match:
CHEMBL2040552

L: MOLECULE 25
PA_INFA

Docking Scores:
-9.61 -9.39 -5.88
Similarity Score:
31.22%
Best Match:
CHEMBL2040578

L: MOLECULE 78
PA_INFA

Docking Scores:
-10.40 -9.47 -9.75
Similarity Score:
29.03%
Best Match:
CHEMBL2040578

L: MOLECULE 177
PA_INFA

Docking Scores:
-8.56 -9.49 -10.93
Similarity Score:
24.22%
Best Match:
CHEMBL2040578

L: MOLECULE 20
PA_INFA

Docking Scores:
-8.07 -8.50 -6.10
Similarity Score:
16.03%
Best Match:
CHEMBL1829211