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Docking results

Sortable table and score distributions for docking results. The default view collapses poses to one best pose per ligand so decisions start from compounds, not pose duplicates.

DB SELECTION
Ligand priority Viewer Experiments Reverse docking
651 ligands default: one best pose per compound ★ Native available
L. major DHFR · T03
L. major
Protein: Dihydrofolate reductase
# Compound Alt poses Score ▲ Final rank Inter norm H-bonds Contacts Jaccard Contact recall HB recall HB role recall Assessment ↕ GDS
1 OHD_MAC_5
T03
 0 -14.844 2.7607 -0.7262 5 14 0.36 0.45 0.29 0.20 Reject —
2 TC322
T03
 0 -19.881 1.4957 -0.9069 5 14 0.31 0.40 0.43 0.40 Reject —
3 MK179
T03
 0 -26.854 1.4799 -0.9140 3 19 0.86 0.90 0.29 0.20 Reject —
4 OHD_Leishmania_143
T03
 0 -26.759 1.0736 -1.2247 6 10 0.30 0.35 0.29 0.20 Reject —
5 Z49638306
T03
 0 -32.582 3.1479 -1.0745 7 12 0.28 0.35 0.29 0.20 Weak —

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