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
#1186 2c Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1187 2d Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1188 2e Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1190 [Ru(tpy)(biq)(OH2)]Cl2 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#1194 Ru1 Ru(2) — 3 candidates
GT: {"O": 2, "N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1195 1D Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1196 1E Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1197 1F Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1198 3 Ru(2) — 2 candidates
GT: {"N": 5} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#1200 Ru2,3,1 Ru(2) — 5 candidates
GT: {"N": 6} Pred: {"N": 15}
0.00
Candidates → Complex detail MOL 3D Viewer
#1202 9,[Ru(p-cymene)(dppm)Cl2],R5,b,2 Ru(2) — 2 candidates
GT: {"P": 2} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1214 1 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1215 2 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1216 3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1217 4 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1221 [RuHClCO(PPh3)3] Ru(2) — 0 candidates
GT: {"O": 1, "P": 3} Pred: {}
0.00
Candidates → Complex detail MOL 3D Viewer
#1227 2 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#1228 3 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#1233 1,2 Ru(2) — 3 candidates
GT: {"N": 2, "P": 1, "O": 1} Pred: {"P": 3, "O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1234 3,4 Ru(2) — 3 candidates
GT: {"O": 1, "N": 2, "P": 1} Pred: {"O": 6, "P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1235 4a Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1236 4b Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#1237 4d Ru(2) — 2 candidates
GT: {"N": 3} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#1238 4e Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#1239 4f Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1240 4g,5g Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1241 5a Ru(2) — 3 candidates
GT: {"N": 5, "P": 1} Pred: {"P": 3, "N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1249 8 Ru(2) — 2 candidates
GT: {"O": 1, "P": 1} Pred: {"O": 1, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1250 9 Ru(2) — 2 candidates
GT: {"O": 1, "P": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1251 10 Ru(2) — 2 candidates
GT: {"P": 1, "O": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#1252 11 Ru(2) — 2 candidates
GT: {"P": 1, "O": 1} Pred: {"P": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1253 12 Ru(2) — 2 candidates
GT: {"P": 1, "O": 1} Pred: {"P": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1254 1a Ru(2) — 2 candidates
GT: {"N": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#1255 1b Ru(2) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#1256 [Ru(phen)2ppym]2+ Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#1257 1 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1258 2 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1259 3 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1260 4 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1261 5 Ru(2) — 3 candidates
GT: {"N": 5, "P": 1, "O": 1} Pred: {"P": 3, "O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1262 6 Ru(2) — 3 candidates
GT: {"N": 5, "P": 1, "O": 1} Pred: {"P": 3, "O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1263 7 Ru(2) — 3 candidates
GT: {"N": 5, "P": 1, "O": 1} Pred: {"P": 3, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1264 8 Ru(2) — 3 candidates
GT: {"N": 5, "P": 1, "O": 1} Pred: {"P": 3, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1265 RAPTA-EA1 Ru(2) — 2 candidates
GT: {"N": 4, "P": 1} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1266 1 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1267 2 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1268 3 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1269 4 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1270 Complex 3 Ru(2) — 3 candidates
GT: {"N": 6, "P": 1, "O": 1} Pred: {"P": 3, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1272 2a Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
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