trial #445 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: molecule_mod
PA_INFA

Docking Scores:
-5.80 -3.67 -4.01
Similarity Score:
19.67%
Best Match:
CHEMBL1829211

L: molecule
PA_INFA

Docking Scores:
-5.04 -3.19 -3.69
Similarity Score:
9.84%
Best Match:
CHEMBL1829211

L: molecule_mod
PA_INFB

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

L: molecule
PA_INFB

Docking Scores:
-3.77
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
PB2_A-H3N2

Docking Scores:
-4.67 -4.96
Similarity Score:
N/A
Best Match:
N/A

L: molecule
PB2_A-H3N2

Docking Scores:
-4.21 -4.32
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
PB2_A-H5N1

Docking Scores:
-4.60 -4.51 -4.68
Similarity Score:
N/A
Best Match:
N/A

L: molecule
PB2_A-H5N1

Docking Scores:
-4.07 -4.03 -4.12
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
PB2_INFB

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

L: molecule
PB2_INFB

Docking Scores:
-4.43
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
PB3_A-H3N2

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

L: molecule
PB3_A-H3N2

Docking Scores:
-4.26
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
PB4_A-H3N2

Docking Scores:
-4.54
Similarity Score:
N/A
Best Match:
N/A

L: molecule
PB4_A-H3N2

Docking Scores:
-4.05
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
PLP_SARS

Docking Scores:
-5.46 -5.43 -5.53
Similarity Score:
12.63%
Best Match:
CHEMBL222735

L: molecule
PLP_SARS

Docking Scores:
-4.71 -4.68 -4.68
Similarity Score:
7.89%
Best Match:
CHEMBL212454

L: molecule_mod
PLP_SARS2

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

L: molecule
PLP_SARS2

Docking Scores:
-3.56
Similarity Score:
N/A
Best Match:
N/A

L: molecule_mod
PM_9VIRU

Docking Scores:
-5.13 -5.02
Similarity Score:
N/A
Best Match:
N/A

L: molecule
PM_9VIRU

Docking Scores:
-4.15 -3.72
Similarity Score:
N/A
Best Match:
N/A