Nirmatrelvir modification 02 #419 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Nirmatrelvir
G1_ADNV

Docking Scores:
-3.85 -6.25 -6.33
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
G1_ADNV

Docking Scores:
-4.33 -6.77 -6.82
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
G2_ADNV

Docking Scores:
-7.41 -6.92 -6.95
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
G2_ADNV

Docking Scores:
-8.68 -9.29 -7.63
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GB_HHV11

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

L: Nirmatrelvir Modify 02
GB_HHV11

Docking Scores:
-7.54
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GB_HHV1K

Docking Scores:
-7.10 -6.68
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
GB_HHV1K

Docking Scores:
-8.57 -8.32
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GD_9ALPH

Docking Scores:
-7.63 -5.57
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
GD_9ALPH

Docking Scores:
-8.54 -6.65
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GD_HHV1

Docking Scores:
-6.54
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
GD_HHV1

Docking Scores:
-7.23
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GP160_HIV1

Docking Scores:
-6.64 -6.16 -6.17
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
GP160_HIV1

Docking Scores:
-6.54 -6.98 -6.88
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GP160_HIV2

Docking Scores:
-6.36
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
GP160_HIV2

Docking Scores:
-6.91
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir
GP_EBOV

Docking Scores:
-7.37 -7.05 -7.11
Similarity Score:
33.54%
Best Match:
CHEMBL3125897

L: Nirmatrelvir Modify 02
GP_EBOV

Docking Scores:
-8.25 -8.23 -7.76
Similarity Score:
38.36%
Best Match:
CHEMBL3125895

L: Nirmatrelvir
GP_LASSJ

Docking Scores:
-6.12 -6.16
Similarity Score:
N/A
Best Match:
N/A

L: Nirmatrelvir Modify 02
GP_LASSJ

Docking Scores:
-6.08 -6.92
Similarity Score:
N/A
Best Match:
N/A