Molecular graph center, a novel approach to locate the center of a molecule and a new centric index

Journal of Molecular Structure: THEOCHEM

Volumn 635, Issue 1-3, 2003, Pages 105-113

  Hu, Qian Nan ^a   Liang, Yi Zeng ^a   Ren, Feng Lian ^a  

^a CENTRAL SOUTH UNIVERSITY   (China)

Author keywords

Centric index; Compactness; Graph theory; Molecular graph center; Substituent position

Indexed keywords

ALGORITHM; ARTICLE; BALANCE FUNCTION VECTOR; CALCULATION; CENTRIC INDEX; CHEMICAL BINDING; CHEMICAL GRAPH; CHEMICAL STRUCTURE; INTERMETHOD COMPARISON; ITERATIVE VERTEX; MATHEMATICAL ANALYSIS; MATHEMATICAL PARAMETERS; MATHEMATICS; MOLECULAR BIOLOGY; MOLECULAR GRAPH CENTER; MOLECULAR MODEL; STRUCTURE ANALYSIS; VALIDATION PROCESS;

EID: 0042879397     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(03)00386-5     Document Type: Article

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