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
#4670 1 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#4671 2 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4672 3 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4673 4 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 5}
0.00
Candidates → Complex detail MOL 3D Viewer
#4674 5 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 5}
0.00
Candidates → Complex detail MOL 3D Viewer
#4676 Ru2 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4678 Ru4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#4680 C2 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4681 C8 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4682 C11 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4683 JRu Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4686 Ru–B Ru(2) — 2 candidates
GT: {"N": 7} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4687 1 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4688 2 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4689 3 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4690 4 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4691 5 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4692 6 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4693 7 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4694 8 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4695 9 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4696 10 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4697 11 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4698 12 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4699 3a Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4700 3b Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4701 [Ru(N4MacL1)Cl2] Ru(2) — 1 candidates
GT: {"N": 4} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4702 [Ru(N4MacL2)Cl2] Ru(2) — 1 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4703 [Ru(N4MacL3)Cl2] Ru(2) — 1 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4705 RuH Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#4708 2b Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.00
Candidates → Complex detail MOL 3D Viewer
#4709 3 Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4710 1 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4711 2 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4712 3 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4713 4 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4714 5 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4715 6 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4716 7 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4717 8 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"S": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4718 Ru1β Ru(2) — 3 candidates
GT: {"O": 2, "P": 1} Pred: {"O": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4719 Ru1α Ru(2) — 3 candidates
GT: {"O": 2, "P": 1} Pred: {"O": 5, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4720 Ru2β Ru(2) — 3 candidates
GT: {"O": 2, "P": 1} Pred: {"O": 4, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4721 Ru2α Ru(2) — 3 candidates
GT: {"O": 2, "P": 1} Pred: {"O": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#4722 Ru3 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1, "O": 2} Pred: {"N": 3, "P": 3, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4723 Ru4 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1, "O": 2} Pred: {"P": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4724 Ru5 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1, "O": 2} Pred: {"O": 4, "P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4735 1 Ru(2) — 0 candidates
GT: {"O": 1, "P": 3} Pred: {}
0.00
Candidates → Complex detail MOL 3D Viewer
#4736 1 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4739 4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
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