homecomplexesD-MPNN

D-MPNN Donor Prediction

Sequential multi-lig (7058) — 7058 complexes
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)⇄ Compare
87
Exact (1.0)
2026
Partial (>0)
4945
No match
0.159
Mean score
Reset
#2757 3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2758 1,4 (Cl),IX Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2759 3A Ru(2) — 3 candidates
GT: {"N": 4, "O": 2, "P": 1} Pred: {"N": 5, "O": 4, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2761 3 Ru(2) — 0 candidates
GT: {"O": 1, "P": 1, "N": 4} Pred: {}
0.00
Candidates → Complex detail MOL 3D Viewer
#2764 2 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2765 3,1,4 Ru(2) — 3 candidates
GT: {"N": 5} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
#2766 C1 Ru(2) — 3 candidates
GT: {"N": 4} Pred: {"O": 2, "N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2767 C2 Ru(2) — 3 candidates
GT: {"O": 1, "N": 4} Pred: {"O": 2, "N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2768 C3 Ru(2) — 3 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2769 C5 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"S": 2, "N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#2779 Ru3 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 8}
0.00
Candidates → Complex detail MOL 3D Viewer
#2789 Taxifolin ruthenium-p-cymene complex Ru(2) — 2 candidates
GT: {"O": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2790 Ru1 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#2791 Ru3 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2792 С1 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"S": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2793 С2 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"O": 1, "S": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2794 С3 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"S": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2795 1b Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2796 1с Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2797 1d Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2798 2b Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2799 3b Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2800 4b Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2815 1m Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2816 2m Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2817 3m Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2818 4m Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"O": 3, "S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2819 5m Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2820 6m Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2821 1b Ru(2) — 3 candidates
GT: {"N": 2, "O": 1, "P": 1} Pred: {"O": 3, "S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2822 2b Ru(2) — 3 candidates
GT: {"N": 2, "O": 1, "P": 1} Pred: {"O": 3, "S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2823 3b Ru(2) — 3 candidates
GT: {"N": 2, "O": 1, "P": 1} Pred: {"O": 3, "S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2824 4b Ru(2) — 3 candidates
GT: {"N": 2, "O": 1, "P": 1} Pred: {"O": 3, "S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2825 5b Ru(2) — 3 candidates
GT: {"N": 2, "O": 1, "P": 1} Pred: {"O": 3, "S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2826 6b Ru(2) — 3 candidates
GT: {"N": 2, "O": 1, "P": 1} Pred: {"O": 3, "S": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2828 1 Ru(2) — 2 candidates
GT: {"O": 1} Pred: {"O": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2829 2 Ru(2) — 2 candidates
GT: {"O": 1} Pred: {"O": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2830 3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2831 1 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2832 2 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2833 3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2834 1 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2835 2 Ru(2) — 2 candidates
GT: {"N": 3, "O": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2836 2a Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2837 2b Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2838 2c Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2839 2d Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2, "S": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2840 2e Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2, "S": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2841 2f Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"S": 1, "O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2842 1 Ru(2) — 2 candidates
GT: {"O": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
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