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
#3715 12 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3716 2 Ru(2) — 2 candidates
GT: {"N": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3717 3 Ru(2) — 2 candidates
GT: {"N": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3719 4 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 8}
0.00
Candidates → Complex detail MOL 3D Viewer
#3720 9 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3721 10 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3722 [11]PF₆ Ru(2) — 3 candidates
GT: {"N": 2} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#3723 [12]PF₆ Ru(2) — 3 candidates
GT: {"N": 2} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#3724 1 Ru(2) — 3 candidates
GT: {"P": 2, "N": 3} Pred: {"P": 2, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3725 2 Ru(2) — 4 candidates
GT: {"P": 2, "N": 2} Pred: {"P": 5, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3727 2 Ru(2) — 4 candidates
GT: {"N": 8} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#3728 1 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3729 2 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3730 3 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3731 4 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3732 5 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3733 α-[Ru(azpy)2(ox)], 2 Ru(2) — 3 candidates
GT: {"O": 2, "N": 6} Pred: {"O": 6, "N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3734 α-[Ru(azpy)2(mal)], 3 Ru(2) — 3 candidates
GT: {"O": 2, "N": 6} Pred: {"O": 6, "N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3735 α-[Ru(azpy)2(cbdca-O,O‘)], 1 Ru(2) — 3 candidates
GT: {"O": 2, "N": 6} Pred: {"O": 6, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3736 1 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3737 2 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3738 3,2 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3739 4 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3740 5 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3741 6,3 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3742 7,4 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3743 8 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3744 9 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3749 α-[Ru(azpy)2Cl2] Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3751 3a Ru(2) — 3 candidates
GT: {"O": 1, "N": 3} Pred: {"O": 2, "N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#3752 4a Ru(2) — 3 candidates
GT: {"O": 1, "N": 3} Pred: {"O": 2, "N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#3753 6a Ru(2) — 3 candidates
GT: {"O": 1, "N": 3} Pred: {"O": 2, "N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#3754 7a Ru(2) — 3 candidates
GT: {"O": 1, "N": 3} Pred: {"O": 2, "N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#3755 3 Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"S": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3756 4 Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"S": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3757 1 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3758 2 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3759 4 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3760 5 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3763 2 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3764 3 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3766 2 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3767 3 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3768 4 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3769 5 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3770 6 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3771 7 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3772 8 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3773 9 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3774 1b Ru(2) — 3 candidates
GT: {"N": 3, "P": 2} Pred: {"P": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
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