Skip to main content
SpringerLink
Log in

An optimization of the procedure for the calculation of Hosoya's index

  • Published:
Journal of Mathematical Chemistry Aims and scope Submit manuscript

Abstract

An optimized procedure for the calculation of Hosoya's topological index is presented. The procedure has been implemented in PASCAL. The described procedure could be simply modified for calculations of different modifications of Hosoya's index and Merrifield-Simmon's index. As an example, four useful modifications of Hosoya's index are defined.

This is a preview of subscription content, log in via an institution to check access.

Access this article

Log in via an institution

Price excludes VAT (USA)
Tax calculation will be finalised during checkout.

Instant access to the full article PDF.

Institutional subscriptions

Similar content being viewed by others

References

  1. H. Hosoya, Bull. Chem. Soc. Japan 44 (1971) 2332.

    Google Scholar 

  2. A.T. Balaban, I. Motoc, D. Bonchev and O. Mekenyan, Top. Curr. Chem. 114 (1983) 38.

    Google Scholar 

  3. I. Gutman and O. Polanski,Mathematical Concepts in Organic Chemistry (Akademie-Verlag, Berlin, 1987).

    Google Scholar 

  4. D. Bonchev, O. Mekenyan and N. Trinajstić, J. Comp. Chem. 2 (1981) 127.

    Google Scholar 

  5. I. Gutman, Z. Marković and S. Marković, Chem. Phys. Lett. 134 (1987) 139.

    Google Scholar 

  6. S.S. Tratch and N.S. Zefirov,Proc. 8th USSR Conf. on Application of Computers in Molecular Spectroscopy and Chemical Studies (novosibirsk, 1989), p. 210.

  7. M.I. Trofimov, J. Pascal, Ada & Modula-2, 9, 3 (1990) 6.

    Google Scholar 

  8. . Hosoya, J. Chem. Doc. 12 (1972) 181.

    Google Scholar 

  9. M.I. Trofimov,PASCAL vs. PASCAL: the Slow Sets (in press).

  10. R.E. Merrifield and H.E. Simmons, Theor. Chim. Acta 55 (1980) 55.

    Google Scholar 

  11. M. Trofimov,Proc. 6th USSR Conf. on Mathematical MEthods in Chemsitry (Novocherkassk, 1989), p. 32.

Download references

Author information

Authors and Affiliations

  1. Laboratory of Computer Chemistry, N.D. Zelinksy Institute of Organic Chemistry, USSR Academy of Sciences, Leninsky Prospect 47, 117913, Moscow, USSR

    Michael I. Trofimov

Authors
  1. Michael I. Trofimov
    View author publications

    You can also search for this author in PubMed Google Scholar

Rights and permissions

Reprints and permissions

About this article

Cite this article

Trofimov, M.I. An optimization of the procedure for the calculation of Hosoya's index. J Math Chem 8, 327–332 (1991). https://doi.org/10.1007/BF01166946

Download citation

  • Received:

  • Issue Date:

  • DOI: https://doi.org/10.1007/BF01166946

Keywords

Search

Navigation