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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 demo
18 ligands default: one best pose per compound
T. brucei R5P · T12
T. brucei PDB 6FXS
Protein: Ribose-5-phosphate isomerase B
# Compound Alt poses Score ▲ Final rank Inter norm H-bonds Contacts Assessment ↕ GDS
1 KB_chagas_219
T12
0 -27.516 1.3004 -0.9682 8 18 Reject
2 Z275022778
T12
0 -29.280 4.0151 -0.9400 7 18 Weak
3 Z27167190
T12
0 -27.016 2.6097 -1.3388 8 13 Promising
4 OHD_ACDS_73
T12
0 -25.269 2.6168 -0.9431 12 12 Weak
5 ulfkktlib_1132
T12
0 -23.360 5.5071 -1.0000 13 17 Reject

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