3
Candidates
{"N": 8}
Ground Truth
{"N": 13}
Top-1 Prediction
0.615
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
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.59 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.98 ± 0.03
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]<-[n]1c2c34
#1
TOP-1
0.97 ± 0.02
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]5(<-[n]1c2c34)<-[n]1c(C)ccc2ccc3ccc(C)[n]->5c3c21
#1
TOP-1
0.80 ± 0.26
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]567(<-[n]8cccc9c%10[nH]c(/C=C/c%11ccc(F)cc%11)[n]->5c%10c5ccc[n]->6c5c9...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.38 ± 0.00
Cc1ccc2ccc3ccc(C)[n](->[Ru+2]4(<-[n]5c(/C=C/c6ccc(F)cc6)[nH]c6c7cccnc7c7ncccc7c65)<-[n]5c(C)ccc6ccc7...
#2
0.01 ± 0.01
Cc1ccc2ccc3ccc(C)[n](->[Ru+2])c3c2n1
#2
0.09 ± 0.15
Cc1ccc2ccc3cc[c]4(C)->[Ru+2]5(<-[n]6c(C)ccc7ccc8ccc(C)[n]->5c8c76)<-[n]4c3c2n1
#2
0.64 ± 0.44
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]56(<-[n]7cccc8c9[nH]c(/C=C/c%10ccc(F)cc%10)[n]->5c9c5cccnc5c87)(<-[n]1c...
#3
0.35 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]5(<-[n]1c2c34)<-[n]1c(C)ccc2ccc3ccc(C)[n]->5c3c21
#3
0.35 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]5(<-[n]1c2c34)<-[n]1c(C)ccc2ccc3ccc(C)[n]->5c3c21
#3
0.35 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]5(<-[n]1c2c34)<-[n]1c(C)ccc2ccc3ccc(C)[n]->5c3c21
#3
0.35 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]5(<-[n]1c2c34)<-[n]1c(C)ccc2ccc3ccc(C)[n]->5c3c21
#3
0.35 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]5(<-[n]1c2c34)<-[n]1c(C)ccc2ccc3ccc(C)[n]->5c3c21
#3
0.35 ± 0.00
Cc1ccc2ccc3ccc(C)[n]4->[Ru+2]5(<-[n]1c2c34)<-[n]1c(C)ccc2ccc3ccc(C)[n]->5c3c21