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
#798 4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#800 6 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#802 8 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#805 6b Ru(2) — 3 candidates
GT: {"N": 5, "S": 1} Pred: {"S": 6, "N": 6}
0.50
Candidates → Complex detail MOL 3D Viewer
#844 3 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#845 4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#852 Ru1 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#853 Ru2 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#856 RuFF-NPs Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#869 NBD-Ru Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 9}
0.50
Candidates → Complex detail MOL 3D Viewer
#879 Ru-complex 4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#900 3a Ru(2) — 2 candidates
GT: {"P": 1, "N": 1, "O": 1} Pred: {"P": 2, "N": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#902 3c Ru(2) — 2 candidates
GT: {"P": 1, "N": 1, "O": 1} Pred: {"P": 2, "N": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#935 3 Ru(2) — 3 candidates
GT: {"N": 4, "S": 1, "P": 1} Pred: {"N": 5, "S": 5, "P": 2}
0.50
Candidates → Complex detail MOL 3D Viewer
#936 4 Ru(2) — 3 candidates
GT: {"S": 2, "N": 2, "P": 2} Pred: {"S": 5, "N": 5, "P": 2}
0.50
Candidates → Complex detail MOL 3D Viewer
#967 [Ru(bpy)2L]Cl2 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#968 [Ru(phendione)2L]Cl2 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1007 Ru1 Ru(2) — 2 candidates
GT: {"O": 1, "P": 2} Pred: {"O": 2, "P": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1057 1,2 Ru(2) — 3 candidates
GT: {"S": 1, "N": 3, "P": 2} Pred: {"N": 7, "S": 3, "P": 2}
0.50
Candidates → Complex detail MOL 3D Viewer
#1063 1 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1064 2 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1065 3 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1066 4 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1068 6 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1069 7 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1070 8 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1071 9 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1072 10 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1074 12 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 9, "O": 3}
0.50
Candidates → Complex detail MOL 3D Viewer
#1075 13 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1076 14 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1077 15 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1078 16 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1079 17 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1080 18 Ru(2) — 3 candidates
GT: {"O": 1, "N": 5} Pred: {"N": 9, "O": 3}
0.50
Candidates → Complex detail MOL 3D Viewer
#1081 19 Ru(2) — 3 candidates
GT: {"O": 1, "N": 5} Pred: {"O": 3, "N": 9}
0.50
Candidates → Complex detail MOL 3D Viewer
#1082 20 Ru(2) — 3 candidates
GT: {"O": 1, "N": 5} Pred: {"O": 3, "N": 9}
0.50
Candidates → Complex detail MOL 3D Viewer
#1083 21 Ru(2) — 3 candidates
GT: {"N": 5, "O": 1} Pred: {"N": 11, "O": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1164 1 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1167 4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1169 Ru-Biotin Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 11, "S": 1}
0.50
Candidates → Complex detail MOL 3D Viewer
#1242 1 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1308 3Ph(2+) Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1309 1Me(2+) Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1313 3 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1314 4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1316 Ru1 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1317 Ru2,Ru4 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1345 2 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
#1346 3 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 12}
0.50
Candidates → Complex detail MOL 3D Viewer
«‹ 16171819202122232425 ›» 21/142 (7058 total)