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
#3854 2 Ru(2) — 3 candidates
GT: {"N": 3, "P": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3856 1 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"O": 3, "N": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3857 2 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"O": 3, "N": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3858 3 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"N": 3, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3859 4 Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"N": 6, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3861 1 Ru(2) — 2 candidates
GT: {"N": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3863 2a Ru(2) — 3 candidates
GT: {"N": 6, "P": 1} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#3868 Ru2 Ru(2) — 3 candidates
GT: {"S": 2, "O": 2, "N": 2} Pred: {"O": 3, "S": 2, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3873 Ru1 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#3882 Complex 1 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3883 Complex 2 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3884 Complex 3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3885 Complex 4 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3886 Complex 5 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 2, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3887 Complex 6 Ru(2) — 2 candidates
GT: {"O": 1, "N": 2} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3888 R-1a Ru(2) — 2 candidates
GT: {"P": 1} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3889 R-2a Ru(2) — 2 candidates
GT: {"P": 1} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3890 R-1b Ru(2) — 2 candidates
GT: {"P": 1, "O": 2} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3891 R-2b Ru(2) — 2 candidates
GT: {"P": 1, "O": 2} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3893 9 (SPh) Ru(2) — 2 candidates
GT: {"N": 2, "P": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3894 10 (SePh) Ru(2) — 2 candidates
GT: {"N": 2, "P": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3895 11 (SMe) Ru(2) — 2 candidates
GT: {"N": 2, "P": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3896 12 (SeMe) Ru(2) — 2 candidates
GT: {"N": 2, "P": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3897 Complex Ru(2) — 2 candidates
GT: {"N": 7} Pred: {"S": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3900 1a Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3901 2a Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3902 3a Ru(2) — 2 candidates
GT: {"N": 5} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3905 1a Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3906 1b Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3907 1c Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3908 1d Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3909 2a Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3910 2b Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3911 2c Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3912 2d Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3913 2e Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3915 5 Ru(2) — 2 candidates
GT: {"N": 2, "O": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3916 6 Ru(2) — 2 candidates
GT: {"N": 2, "O": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3917 7 Ru(2) — 2 candidates
GT: {"N": 3} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#3918 2 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#3919 2 Ru(2) — 4 candidates
GT: {"N": 6} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#3920 Ru2 Ru(2) — 3 candidates
GT: {"O": 1, "N": 5} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
#3924 RuT7,7 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3927 Ru5 Ru(2) — 3 candidates
GT: {"N": 2, "S": 1, "P": 4} Pred: {"S": 3, "N": 3, "P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3928 1 Ru(2) — 2 candidates
GT: {"P": 1} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3929 2 Ru(2) — 2 candidates
GT: {"P": 1} Pred: {"P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#3930 3 Ru(2) — 2 candidates
GT: {"P": 1, "O": 2} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3932 1 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 8}
0.00
Candidates → Complex detail MOL 3D Viewer
#3938 [(η6-p-cymene)RuCl(κ2-dppp)]Cl Ru(2) — 2 candidates
GT: {"P": 2} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#3942 C4 Ru(3) — 1 candidates
GT: {"N": 3} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
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