Results for job: Drug_NAI
Downloadable Files
Ranking-top10 molecules
| Rank | Name | Score | Poses |
| 1 | Zanamivir | 77.2573 | Pose |
| 2 | Peramivir | 52.1375 | Pose |
| 3 | Ribostamycin | 45.4847 | Pose |
| 4 | Oseltamivir | 42.3765 | Pose |
| 5 | Alitretinoin | 38.7226 | Pose |
| 6 | Nalidixic acid | 36.3359 | Pose |
| 7 | Vincristine | 36.3311 | Pose |
| 8 | Metrizoic acid | 35.8385 | Pose |
| 9 | Colchicine | 34.8654 | Pose |
| 10 | Nedocromil | 34.8024 | Pose |
Top 10 Molecular Structures
Rank 1
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Zanamivir
Score: 77.2573
Rank 2
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Peramivir
Score: 52.1375
Rank 3
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Ribostamycin
Score: 45.4847
Rank 4
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Oseltamivir
Score: 42.3765
Rank 5
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Alitretinoin
Score: 38.7226
Rank 6
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Nalidixic acid
Score: 36.3359
Rank 7
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Vincristine
Score: 36.3311
Rank 8
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Metrizoic acid
Score: 35.8385
Rank 9
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Colchicine
Score: 34.8654
Rank 10
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Nedocromil
Score: 34.8024
Interactions
Hydrogen Bond
Halogen Bond
Pi-Stacking
Pi-Cation
Hydrophobic Interaction
Salt Bridge
| Residue | Chain | Atom on Protein | Is Acceptor | Atom on Ligand |
|---|
| Residue | Chain | Atom on Protein | Atom on Ligand |
|---|