Case_study_1_mini #498 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Paxlovid
NP_HCoV-OC43

Docking Scores:
-8.25 -6.90 -6.77
Similarity Score:
15.25%
Best Match:
CHEMBL3233481

L: Molnupiravir
NP_HCoV-OC43

Docking Scores:
-7.18 -6.86 -6.53
Similarity Score:
11.54%
Best Match:
CHEMBL3233481

L: Paxlovid
NP_INFB

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

L: Molnupiravir
NP_INFB

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

L: Paxlovid
NP_INFD

Docking Scores:
-5.07
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NP_INFD

Docking Scores:
-5.11
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NP_LASSJ

Docking Scores:
-9.13 -8.81 -5.12
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NP_LASSJ

Docking Scores:
-8.49 -8.45 -4.97
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NP_SARS

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

L: Molnupiravir
NP_SARS

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

L: Paxlovid
NS1_9CALI

Docking Scores:
-5.43 -5.57 -6.15
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NS1_9CALI

Docking Scores:
-5.36 -5.49 -6.26
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NS1_9FLAV

Docking Scores:
-5.35
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NS1_9FLAV

Docking Scores:
-5.50
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NS1_DEN1W

Docking Scores:
-5.47
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NS1_DEN1W

Docking Scores:
-5.46
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NS1_ZIKV

Docking Scores:
2.43 -6.46 -7.10
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NS1_ZIKV

Docking Scores:
-6.60 -6.35 -6.61
Similarity Score:
N/A
Best Match:
N/A

L: Paxlovid
NS2A_9FLAV

Docking Scores:
-4.48
Similarity Score:
N/A
Best Match:
N/A

L: Molnupiravir
NS2A_9FLAV

Docking Scores:
-4.11
Similarity Score:
N/A
Best Match:
N/A