3
Candidates
{"N": 6}
Ground Truth
{"N": 7}
Top-1 Prediction
0.857
Match Score
⚠ Per-candidate scores unavailable for sequential. Showing 30 candidates from single-ligand scoring.
For sequential results only top-1 prediction is stored.
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.36 ± 0.00
c1ccc2c(c1)[n]1->[Ru+2]34<-[n]5cccc6c5c5c(ccc[n]->35)c(c61)[n]->42
#1
TOP-1
0.96 ± 0.03
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]<-[n]4cccc1c4c23
#1
TOP-1
0.31 ± 0.44
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6cc(C(=O)NCCCCCC[P+](c7c...
#1
TOP-1
0.36 ± 0.40
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]45(<-[n]6cccc7cc(C(=O)NCCCCCC[P+](c8...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.06 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[n]5cccc6c7nc8ccccc8[n]->4c7c4cc...
#2
0.03 ± 0.03
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2cccnc2c2c1ccc[n]2->[Ru+2]
#2
0.16 ± 0.36
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]4(<-[O]=C(NCCCCCC[P+](c5ccccc5)(c5cc...
#2
0.28 ± 0.42
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2ccc[n]3->[Ru+2]456(<-[n]7cccc8c7c7ncccc7c7c8[n]->4c...
#3
0.04 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2cccnc2c2c1ccc[n]2->[Ru+2]12(<-[n]3cccc4c3c3ncccc3c3...
#3
0.04 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2cccnc2c2c1ccc[n]2->[Ru+2]12(<-[n]3cccc4c3c3ncccc3c3...
#3
0.04 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2cccnc2c2c1ccc[n]2->[Ru+2]12(<-[n]3cccc4c3c3ncccc3c3...
#3
0.04 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2cccnc2c2c1ccc[n]2->[Ru+2]12(<-[n]3cccc4c3c3ncccc3c3...
#3
0.04 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2cccnc2c2c1ccc[n]2->[Ru+2]12(<-[n]3cccc4c3c3ncccc3c3...
#3
0.04 ± 0.00
O=C(NCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc2cccnc2c2c1ccc[n]2->[Ru+2]12(<-[n]3cccc4c3c3ncccc3c3...