Interrelationship of Major Topological Indices Evidenced by Clustering

Croatica Chemica Acta

Gute, Brian D.¹  Basak, Subhash C.¹  Balaban, Alexandru T.² 

[1] Natural Resources Research Institute, University of Minnesota Duluth, Duluth, MN 55811, USA;Texas A&M University at Galveston, Department of Marine Sciences, 5007 Avenue U, Galveston, TX 77551, USA

关键词: topological indices;    cluster analysis;    diverse compounds databases;   

DOI  :  

学科分类：化学（综合）

来源: Croatica Chemica Acta

【 摘 要 】

This study examines the mutual relatedness of 318 major topological indices (TIs) for three sets of molecules: (i) a set of 139 hydrocarbons, (ii) a diverse set of 1029 compounds and (iii) a diverse set of 2887 compounds. The TIs...

【 授权许可】

Unknown