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
#6009 8a Ir(3) — 2 candidates
GT: {"N": 8} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6010 8b Ir(3) — 2 candidates
GT: {"N": 6} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6011 9a Ir(3) — 2 candidates
GT: {"N": 6} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#6012 9b Ir(3) — 2 candidates
GT: {"N": 7} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6013 1 Ir(3) — 2 candidates
GT: {"N": 3} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#6014 Ir-rhod Ir(3) — 2 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#6015 3a Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6016 7a Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6017 7b Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6018 7c Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6019 Ir1 Ir(3) — 3 candidates
GT: {"N": 8} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6021 Ir3 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 4, "S": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6022 Ir4 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6023 Ir1 Ir(3) — 3 candidates
GT: {"N": 7} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6024 Ir2 Ir(3) — 3 candidates
GT: {"N": 7} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6025 Ir3 Ir(3) — 3 candidates
GT: {"N": 7} Pred: {"N": 7, "S": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6026 2 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6027 3 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6028 4 Ir(3) — 3 candidates
GT: {"N": 5} Pred: {"N": 5}
0.00
Candidates → Complex detail MOL 3D Viewer
#6029 Ir-OH Ir(3) — 3 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6030 Ir-ART Ir(3) — 3 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#6031 Ir1 Ir(3) — 2 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#6032 Ir2 Ir(3) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6033 Ir3 Ir(3) — 2 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#6034 Ir4 Ir(3) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6035 1 Ir(3) — 3 candidates
GT: {"N": 7} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6036 IrL1 Ir(3) — 3 candidates
GT: {"N": 7} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6039 IrL4 Ir(3) — 3 candidates
GT: {"N": 7} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6040 IrL5 Ir(3) — 3 candidates
GT: {"N": 7} Pred: {"O": 10, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6044 IrL1 Ir(3) — 3 candidates
GT: {"N": 5} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6045 Ir1 Ir(3) — 3 candidates
GT: {"N": 8} Pred: {"N": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#6046 Ir2 Ir(3) — 3 candidates
GT: {"N": 8} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#6047 Ir3 Ir(3) — 3 candidates
GT: {"N": 8} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#6048 Ir1 Ir(3) — 3 candidates
GT: {"N": 5} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6049 Ir2 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6050 Ir3 Ir(3) — 3 candidates
GT: {"N": 5} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#6051 Ir4 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#6052 Ir5 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6053 1 Ir(3) — 2 candidates
GT: {"O": 2, "N": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6054 2 Ir(3) — 2 candidates
GT: {"O": 2, "N": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6055 3 Ir(3) — 2 candidates
GT: {"O": 2, "N": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#6056 Ir1 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6057 Ir2 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6058 Ir3 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6059 Ir1 Ir(3) — 3 candidates
GT: {"N": 3, "O": 1} Pred: {"O": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6060 Ir2 Ir(3) — 3 candidates
GT: {"N": 3, "O": 1} Pred: {"O": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#6061 Ir3 Ir(3) — 3 candidates
GT: {"N": 3, "O": 1} Pred: {"O": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#6062 Ir4 Ir(3) — 3 candidates
GT: {"N": 3, "O": 1} Pred: {"O": 3, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6063 Ir5 Ir(3) — 3 candidates
GT: {"N": 3, "O": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#6064 Ir6 Ir(3) — 3 candidates
GT: {"N": 3, "O": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
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