Hugging Face's logo

Datasets:
OsBaran
/
polymer_density_dataset

Modalities:
Text
Formats:
parquet
Size:
1K - 10K
Libraries:
Datasets
pandas
Dataset card Data Studio Files
xet
Community
1
Dataset Viewer
Auto-converted to Parquet Duplicate
SMILES
stringlengths
4
164
Density
float64
0.74
1.91
*/C(=C/CC*)C
0.883357
*/C(=C\CC*)C(C)(C)C
0.865139
*/C(C)=C(/*)C(C)C
0.742359
*/C(Cl)=C(/*)c1ccccc1
1.076752
*/C=C(/*)C(C)(C)C
0.776288
*/C=C(/*)c1ccc(-c2ccc(C#C)cc2)cc1
1.042091
*/C=C(/*)c1ccc(C#C)cc1
1.010292
*/C=C(/*)c1cccc(C#C)c1
1.01683
*/C=C/C(C(=O)OCc1ccc(Cl)cc1)C(*)C(=O)OCc1ccc(Cl)cc1
1.258572
*/C=C/C(C*)C(CC)C
0.85054
*/C=C/C(C*)OC
1.003982
*/C=C/C1CC(*)C2C(=O)N(CCCCC)C(=O)C12
1.050824
*/C=C/C1CC(*)C2C(=O)N(CCCCCC)C(=O)C12
1.035218
*/C=C/CC*
0.883045
*/C=C/CCC*
0.870773
*/C=C/CCCCCCCCCC*
0.853346
*/C=C\*
0.959011
*/C=C\CC*
0.891055
*/C=C\CCC*
0.876839
*/C=C\CCCC*
0.868417
*/C=C\CCCCC*
0.867589
*C#C/C(=C(*)\COS(=O)(=O)c1ccc(cc1)C)COS(=O)(=O)c1ccc(cc1)C
1.251976
*C(*)C(=O)OC
1.15076
*C(*)C(=O)OC(C)C
1.034629
*C(*)C(=O)OCC
1.092478
*C(*)C(=O)OCCC
1.065853
*C(=CCC*)C(C)C
0.849541
*C(=CCC*)CCC
0.866169
*C(=CCC*)CCCCCCC
0.8501
*C(=CCC*)c1ccccc1
1.017027
*C(=CCCC*)c1ccc(cc1)Cl
1.123125
*C(=CCCC*)c1ccc(cc1)OC
1.035052
*C(=CCCC*)c1ccccc1
1.00582
*C(=O)CCCCCCCCC(=O)N1CCN(*)CC1
1.06836
*C(=O)NC1CCC(CC2CCC(NC(=O)c3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)CC2)CC1
1.133082
*C(=O)NCCNC(=O)c1ccc(N2C(=O)c3ccc(*)cc3C2=O)cc1
1.289378
*C(=O)Nc1ccc(C2(c3ccc(NC(=O)c4ccc5c(c4)C(=O)N(c4ccc(Sc6ccc(Oc7ccc(Sc8ccc(N9C(=O)c%10ccc(*)cc%10C9=O)cc8)cc7)cc6)cc4)C5=O)cc3)c3ccccc3-c3ccccc32)cc1
1.211912
*C(=O)Nc1ccc(Cc2ccc(NC(=O)c3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)cc2)cc1
1.230143
*C(=O)Nc1ccc(NC(=O)c2ccc(N3C(=O)c4ccc(*)cc4C3=O)cc2)cc1
1.300382
*C(=O)Nc1cccc(/C=C/C(=O)/C=C/c2cccc(NC(=O)c3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)c2)c1
1.200829
*C(=O)Nc1cccc(C#Cc2cccc(N3C(=O)c4ccc(*)cc4C3=O)c2)c1
1.207197
*C(=O)Nc1cccc(NC(=O)/C=C/c2cccc(N3C(=O)c4ccc(*)cc4C3=O)c2)c1
1.251503
*C(=O)Nc1cccc(NC(=O)c2ccc(N3C(=O)c4ccc(*)cc4C3=O)cc2)c1
1.288525
*C(=O)Nc1ccccc1NC(=O)c1ccc(N2C(=O)c3ccc(*)cc3C2=O)cc1
1.285201
*C(=O)OCCOC(=O)c1ccc(*)o1
1.294258
*C(=O)Oc1ccc(C(C)(C)c2ccc(OC(=O)c3ccc4c(c3)C(=O)N(c3ccc(-c5ccc(N6C(=O)c7ccc(*)cc7C6=O)c(C)c5)cc3C)C4=O)cc2)cc1
1.160979
*C(=O)Oc1ccc(C(C)(C)c2ccc(OC(=O)c3ccc4c(c3)C(=O)N(c3ccc(-c5ccc(N6C(=O)c7ccc(*)cc7C6=O)cc5)cc3)C4=O)cc2)cc1
1.20945
*C(=O)Oc1ccc(C(C)(C)c2ccc(OC(=O)c3ccc4c(c3)C(=O)N(c3ccc(Oc5ccc(N6C(=O)c7ccc(*)cc7C6=O)cc5)cc3)C4=O)cc2)cc1
1.224361
*C(=O)Oc1ccc(C(C)(C)c2ccc(OC(=O)c3ccc4c(c3)C(=O)n3c-4nc4ccc(Oc5ccc6c(c5)nc5n6C(=O)c6ccc(*)cc6-5)cc43)cc2)cc1
1.233968
*C(=O)Oc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(C2CCC(N4C(=O)c5ccc(*)cc5C4=O)CC2)C3=O)cc1
1.262453
*C(=O)Oc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(c2ccc(-c4ccc(N5C(=O)c6ccc(*)cc6C5=O)cc4C(F)(F)F)c(C(F)(F)F)c2)C3=O)cc1
1.33566
*C(=O)Oc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(c2ccc(C(=O)Nc4ccc(N5C(=O)c6ccc(*)cc6C5=O)cc4)cc2)C3=O)cc1
1.306231
*C(=O)Oc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(c2ccc(C(=O)Oc4ccc(N5C(=O)c6ccc(*)cc6C5=O)cc4)cc2)C3=O)cc1
1.303485
*C(=O)Oc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Oc4ccc(N5C(=O)c6ccc(*)cc6C5=O)cc4)cc2)C3=O)cc1
1.29821
*C(=O)c1ccc2c(c1)C(=O)N(c1c(C(C)C)cc(Cc3cc(C(C)C)c(N4C(=O)c5ccc(*)cc5C4=O)c(C(C)C)c3)cc1C(C)C)C2=O
1.001468
*C(=O)c1ccc2c(c1)C(=O)N(c1c(C)c(C)c(N3C(=O)c4ccc(*)cc4C3=O)c(C)c1C)C2=O
1.095689
*C(=O)c1ccc2c(c1)C(=O)N(c1c(C)cc(C(c3cc(C)c(N4C(=O)c5ccc(*)cc5C4=O)c(C)c3)c3cccc4ccccc34)cc1C)C2=O
1.05285
*C(=O)c1ccc2c(c1)C(=O)N(c1c(C)cc(Cc3cc(C)c(N4C(=O)c5ccc(*)cc5C4=O)c(C)c3)cc1C)C2=O
1.094593
*C(=O)c1ccc2c(c1)C(=O)N(c1c(CC)cc(Cc3cc(CC)c(N4C(=O)c5ccc(*)cc5C4=O)c(CC)c3)cc1CC)C2=O
1.063183
*C(=O)c1ccc2c(c1)C(=O)N(c1cc(C(c3ccc(O)c(N4C(=O)c5ccc(*)cc5C4=O)c3)(C(F)(F)F)C(F)(F)F)ccc1O)C2=O
1.33567
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(-c3ccc(-c4ccc(N5C(=O)c6ccc(*)cc6C5=O)cc4)cc3)cc1)C2=O
1.203392
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(-c3ccc(N4C(=O)c5ccc(*)cc5C4=O)c(C)c3)cc1C)C2=O
1.145827
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(-c3ccc(N4C(=O)c5ccc(*)cc5C4=O)c(OC)c3)cc1OC)C2=O
1.183024
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(-c3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)cc1)C2=O
1.240794
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(C(=O)Nc3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)cc1)C2=O
1.27826
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(C(=O)Nc3cccc(N4C(=O)c5ccc(*)cc5C4=O)c3)cc1)C2=O
1.280038
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(C)c(N3C(=O)c4ccc(*)cc4C3=O)c1)C2=O
1.218703
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(C3(c4ccc(N5C(=O)c6ccc(*)cc6C5=O)cc4)c4ccccc4-c4ccccc43)cc1)C2=O
1.135743
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Cc3ccc(N4C(=O)c5ccc(*)cc5C4=O)c(C)c3)cc1C)C2=O
1.153645
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Cc3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)cc1)C2=O
1.231157
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(N3C(=O)c4ccc(*)cc4C3=O)c(C)c1)C2=O
1.220748
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(N3C(=O)c4ccc(*)cc4C3=O)nc1)C2=O
1.281941
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Oc3c(C)cc(Cc4cc(C)c(Oc5ccc(N6C(=O)c7ccc(*)cc7C6=O)cc5)c(C)c4)cc3C)cc1)C2=O
1.149766
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Oc3cc4ccccc4cc3Oc3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)cc1)C2=O
1.249195
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Oc3ccc(-c4ccc(Oc5ccc(N6C(=O)c7ccc(*)cc7C6=O)cc5)cc4)cc3)cc1)C2=O
1.228224
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Oc3ccc(C(=O)c4cccc(C(=O)c5ccc(Oc6ccc(N7C(=O)c8ccc(*)cc8C7=O)cc6)cc5)c4)cc3)cc1)C2=O
1.236642
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Oc3ccc(C(c4ccc(Oc5ccc(N6C(=O)c7ccc(*)cc7C6=O)cc5)cc4)(C(F)(F)F)C(F)(F)F)cc3)cc1)C2=O
1.291071
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Oc3cccc4c(Oc5ccc(N6C(=O)c7ccc(*)cc7C6=O)cc5)cccc34)cc1)C2=O
1.237242
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Sc3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)cc1)C2=O
1.26794
*C(=O)c1ccc2c(c1)C(=O)N(c1ccc3c(c1)Cc1cc(N4C(=O)c5ccc(*)cc5C4=O)ccc1-3)C2=O
1.231381
*C(=O)c1ccc2c(c1)C(=O)N(c1cccc(C(=O)N(C)c3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)c1)C2=O
1.248996
*C(=O)c1ccc2c(c1)C(=O)N(c1cccc(C(=O)Nc3ccc(N4C(=O)c5ccc(*)cc5C4=O)cc3)c1)C2=O
1.276055
*C(=O)c1ccc2c(c1)C(=O)N(c1cccc(N3C(=O)c4ccc(*)cc4C3=O)c1C)C2=O
1.203975
*C(C(*)(F)F)(Cl)F
1.892082
*C(C(*)(F)F)(OC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F
1.779888
*C(C(*)(F)F)(OC(C(F)(F)F)(F)F)F
1.710361
*C(C(*)(F)F)(OC(C(F)F)F)F
1.696242
*C(C(*)(F)F)(OC(F)(F)F)F
1.816452
*C(C(*)(F)F)(OC(F)(F)F)OC(F)(F)F
1.687186
*C(C(*)(F)F)(c1c(c(c(c(c1F)F)F)F)F)F
1.609094
*C(C(*)(F)F)(c1ccccc1)F
1.277454
*C(C(*)(F)F)OC(F)(F)F
1.726336
*C(C(*)(c1c(c(c(c(c1[2H])[2H])[2H])[2H])[2H])[2H])([2H])[2H]
1.071664
*C(C(*)F)(OC(F)(F)F)F
1.750236
*C(C(*)O)C
1.029485
*C(C(*)OC(C)(C)C)C
0.874168
*C(C(*)OC(C)C)C
0.882336
*C(C(*)OC)C
0.947493
*C(C(*)OCC(C)C)C
0.88966
*C(C(*)OCC)C
0.920916
End of preview. Expand in Data Studio
README.md exists but content is empty.
Downloads last month
6
Size of downloaded dataset files:
27.4 kB
Size of the auto-converted Parquet files:
27.4 kB
Number of rows:
1,070