Quantitative relationship between the physiochemical characteristics as well as genotoxicity of organic pollutants and molecular autocorrelation topological descriptors

Chemosphere

Volumn 35, Issue 12, 1997, Pages 2849-2855

  Huang, Qing Guo ^a   Song, Wen Lu ^a   Wang, Lian Sheng ^a  

^a NANJING UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ORGANIC COMPOUND;

ARTICLE; CHEMICAL STRUCTURE; ECOTOXICOLOGY; GENOTOXICITY; STRUCTURE ACTIVITY RELATION;

EID: 0030700344     PISSN: 00456535     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0045-6535(97)00345-7     Document Type: Article

References (9)

1. Wang Lian-sheng, Han shu-kui. The quantitative structure-activity relationship of organic compounds. Beijing. Chinese Environmental Science Press, 1993(Chinese).
2. Wang Lian-sheng, Molecular connectivity and molecular structure-activity. Beging. Chinese Environmental Science Press, 1992(Chinese).
3. Yao yu-yuan, Xu lu, Yang yu-qiu. (1994). A new topological index and its use in the structure-activity study of organic compounds. 14(1):1-8
4. Moreau, G., and Broto, P. (1980). The autocorrelation of a topological structure: An new molecular descriptor. Nouv. J. Chim, 4:359-360.
5. Devillers, j., Chambon, P., et al. (1986). A new approach in ecotoxicological studies. Chemosphere, 15(8):993-1002
6. Moriguchi I., Kanada Y., Komatsu K. (1976). Van der waals volume and the related parameters for hydrophobicity in structure-activity studies. 24(1):1799-1806
7. Pauling, L. The nature of the chemical bond and the structure of molecules and crystals: An introduction to modern structural chemistry. Third edition, Ithaca, New York. Cornell University Press, 1960:37-38
8. Wang Lian-sheng, Zhao Yuan-hui, and Gao Hong. (1992) Prediction of organism solubility in water and Octanol/Water distribution coefficients through molar volume. Environmental chemistry(Chinese). 11(1):55-63
9. Wang Lian-sheng. (1989). The discussion about the correlationship between the molecular connectivity index and physiochemical parameters. 10(3):1-12