diff options
Diffstat (limited to 'cv/data/csv/RAT_topological.csv')
| -rw-r--r-- | cv/data/csv/RAT_topological.csv | 1024 |
1 files changed, 512 insertions, 512 deletions
diff --git a/cv/data/csv/RAT_topological.csv b/cv/data/csv/RAT_topological.csv index 87bfc55..d7a4fde 100644 --- a/cv/data/csv/RAT_topological.csv +++ b/cv/data/csv/RAT_topological.csv @@ -1,512 +1,512 @@ -SMILES,VP-3,SP-0,ATSm3,SP-1,PetitjeanNumber,ATSm4,khs.sCH3,khs.dssC,VP-4,ATSm5,ATSc1,MDEO-22,VP-5,SP-2,ATSc2,khs.sOH,VP-6,khs.ssCH2,SP-3,Kier1,khs.aasC,ATSc3,VP-7,SP-4,ATSc4,VC-3,ATSp1,fragC,SP-5,Kier2,VC-4,ATSc5,ATSp2,MDEN-33,MDEC-11,SP-6,Kier3,khs.sssCH,VC-5,khs.sssN,ATSp3,MDEC-12,SP-7,MDEC-33,C1SP2,C2SP2,SC-3,ATSp4,MDEC-13,SPC-4,C1SP3,SC-4,khs.sCl,ATSp5,SPC-5,geomShape,C2SP3,WPATH,khs.sNH2,khs.ssO,SPC-6,SCH-5,khs.dO,khs.dsN,SC-5,khs.ssNH,SCH-6,MDEO-11,khs.dsCH,SCH-7,MDEO-12,topoShape,ECCEN,VCH-5,Zagreb,MDEN-22,VPC-4,khs.ddsN,VCH-6,khs.aaCH,VP-0,WPOL,VPC-5,VCH-7,VP-1,TopoPSA,ATSm1,MDEN-23,MDEC-22,VPC-6,VP-2,ATSm2,MDEC-23 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