Ad hoc optimal topological indices for QSPR

Russian Chemical Bulletin

Volumn 55, Issue 9, 2006, Pages 1508-1515

  Smolenskii, E A ^a   Vlasova, G V ^a   Platunov, D Yu ^a   Ryzhov, A N ^a  

^a N D ZELINSKY INSTITUTE OF ORGANIC CHEMISTRY   (Russian Federation)

Author keywords

Alkanes; Chemical structure matrix; Descriptors; Physicochemical properties; Quantitative structure property relationships; Topological indices

Indexed keywords

EID: 33846617661     PISSN: 10665285     EISSN: None     Source Type: Journal    
DOI: 10.1007/s11172-006-0448-z     Document Type: Article

References (15)

1. M. I. Stankevich, I. V. Stankevich, and N. S. Zefirov, Usp. Khim., 1988, 57, 337
2. [Russ. Chem. Rev., 1988, 57 (Engl. Transl.)].
3. T. G. Schmalz, D. J. Klein, and B. L. Sandleback, J. Chem. Inf. Comput. Sci., 1992, 32, 54.
4. E. A. Smolenskii, Izv. Akad. Nauk, Ser. Khim., 2006, 1447
5. [Russ. Chem. Bull., Int. Ed., 2006, 1501].
6. M. Randić, J. Am. Chem. Soc., 1975, 97, 6609.
7. H. Hosoya, Bull. Chem. Soc. Jpn, 1971, 44, 2332.
8. H. Wiener, J. Am. Chem. Soc., 1947, 69, 17.
9. H. Wiener, J. Am. Chem. Soc., 1947, 69, 2636.
10. D. Bonchev, E. Marcel, and A. Dekmezian, J. Chem. Inf. Comput. Sci., 2001, 41, 1274.
11. A. R. Katrizky, R. Petrukhin, R. Jain, and M. Karelson, J. Chem. Inf. Comput. Sci., 2001, 41, 1521.
12. A. V. Kamernitzkii, E. A. Smolenskii, G. M. Makeev, I. V. Vesela, N. M. Mirsalikhova, A. M. Turuta, and N. S. Zefirov, Bioorg. Khim., 2002, 28, 269
13. [Russ. J. Bioorg. Chem., 2002, 28 (Engl. Transl.)].
14. E. A. Smolenskii, Dokl. Akad. Nauk, 1999, 365, 767
15. [Dokl. Chem., 1999 (Engl. Transl.)].