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
#4584 Ru1 Ru(2) — 4 candidates
GT: {"N": 6} Pred: {"N": 8}
0.00
Candidates → Complex detail MOL 3D Viewer
#4585 1 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4586 2 Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4587 3 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4588 4 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4589 6 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4593 4-1 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4594 4-2 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4595 4-3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4596 4-4 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4601 1 Ru(2) — 4 candidates
GT: {"O": 1, "N": 4, "P": 2} Pred: {"O": 4, "N": 6, "P": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#4605 1a Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4606 2a Ru(2) — 2 candidates
GT: {"N": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4609 4 Ru(2) — 3 candidates
GT: {"S": 3, "N": 3} Pred: {"S": 9, "N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4610 5 Ru(2) — 3 candidates
GT: {"S": 3, "N": 3} Pred: {"S": 9, "N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4611 1 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#4612 2 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#4613 4 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4614 5 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4615 7 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4616 8 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4618 Ru2 Ru(2) — 3 candidates
GT: {"N": 4, "S": 1, "P": 2} Pred: {"N": 7, "S": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#4619 Ru3 Ru(2) — 3 candidates
GT: {"N": 4, "S": 1, "P": 1} Pred: {"N": 7, "S": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#4620 RuIQ-3 Ru(2) — 3 candidates
GT: {"N": 5} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4623 Ru(p-cym)(NN)(Cl) Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4630 OA-Ru Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#4636 Ru-ART-6 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#4639 Ru-3 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#4642 Ru-6 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 8}
0.00
Candidates → Complex detail MOL 3D Viewer
#4643 [Ru(TAMacL1)Cl2] Ru(2) — 1 candidates
GT: {"N": 4} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4644 [Ru(TAMacL2)Cl2] Ru(2) — 1 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4645 [Ru(TAMacL3)Cl2] Ru(2) — 1 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4649 1 Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4650 4 Ru(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4651 С2 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4652 С3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4653 1 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4654 2 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4655 3 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4656 5 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4657 6 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#4658 1 Ru(2) — 2 candidates
GT: {"P": 1} Pred: {"P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4659 2 Ru(2) — 2 candidates
GT: {"P": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4660 3 Ru(2) — 2 candidates
GT: {"P": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#4661 4 Ru(2) — 2 candidates
GT: {"P": 1} Pred: {"O": 2, "P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4662 5 Ru(2) — 2 candidates
GT: {"P": 1, "N": 1} Pred: {"P": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4663 6 Ru(2) — 2 candidates
GT: {"N": 1, "P": 1} Pred: {"O": 1, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#4664 7 Ru(2) — 2 candidates
GT: {"P": 1} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#4665 cis-[RuCl(CO)(dppb)(dppz)]+ Ru(2) — 0 candidates
GT: {"O": 1, "P": 2, "N": 4} Pred: {}
0.00
Candidates → Complex detail MOL 3D Viewer
#4669 1 Ru(2) — 2 candidates
GT: {"O": 1} Pred: {"O": 2, "S": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
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