A novel topological index W F is defined by the matrices X,W and L as W F=XWL.The topological index WF based on the distance-related matrix of molecular graphs is used to code the structural environment of each atom...A novel topological index W F is defined by the matrices X,W and L as W F=XWL.The topological index WF based on the distance-related matrix of molecular graphs is used to code the structural environment of each atom-type in a molecular graph.Good QSPR models have been obtained for standard formation enthalpy of methyl halides.The result indicates that the idea of using multiple matrices to define the distance-related matrix topological index is valid.展开更多
基金supported by the National Natural Science Foundation of China （20973164 20903091 20906089 and 21103180） financially supported by the European community the Wallon government in the frame of Interreg IV （France-Wallonie）
文摘A novel topological index W F is defined by the matrices X,W and L as W F=XWL.The topological index WF based on the distance-related matrix of molecular graphs is used to code the structural environment of each atom-type in a molecular graph.Good QSPR models have been obtained for standard formation enthalpy of methyl halides.The result indicates that the idea of using multiple matrices to define the distance-related matrix topological index is valid.
