mini project 083023_YZ #534 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Paxlovid
NA_A-H3N2

Docking Scores:
-6.97 -7.40
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NA_A-H3N2

Docking Scores:
-6.59 -7.31
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NA_A-H3N8

Docking Scores:
-8.53 -8.51 -8.05
Similarity Score:
29.71%
Best Match:
CHEMBL674

L: Molnupiravir
NA_A-H3N8

Docking Scores:
-7.73 -7.75 -7.38
Similarity Score:
22.31%
Best Match:
CHEMBL222813

L: Paxlovid
NA_A-H5N1

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

L: Molnupiravir
NA_A-H5N1

Docking Scores:
-7.42
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NA_A-H7N9

Docking Scores:
-7.93 -7.45 -8.29
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NA_A-H7N9

Docking Scores:
-7.14 -7.24 -7.34
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NA_INFB

Docking Scores:
-7.27 -7.98
Similarity Score:
55.10%
Best Match:
CHEMBL370047

L: Molnupiravir
NA_INFB

Docking Scores:
-7.79 -7.76
Similarity Score:
28.81%
Best Match:
CHEMBL183817

L: Paxlovid
NP_9ADNV

Docking Scores:
-5.14 -7.09
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NP_9ADNV

Docking Scores:
-5.19 -7.30
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NP_A-H1N1

Docking Scores:
-6.47 -6.10 -6.35
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NP_A-H1N1

Docking Scores:
-5.40 -5.82 -7.17
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NP_A-H5N1

Docking Scores:
-6.05
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NP_A-H5N1

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

L: Paxlovid
NP_EBOZM

Docking Scores:
-6.23 -6.12 -7.01
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NP_EBOZM

Docking Scores:
-5.57 -5.85 -6.31
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NP_HCoV-NL63

Docking Scores:
-6.46
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NP_HCoV-NL63

Docking Scores:
-6.43
Similarity Score:
N/A
Best Match:
N/A