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Hydrogen Bonding Models: Their Relevance to Molecular Modeling

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Fundamental Principles of Molecular Modeling

Abstract

In the last twenty years the words model and modeling have come into a somewhat acritical use to identify a number of different methods and concepts pertaining to both social and physical sciences. Even restricting our interest to the purely physical aspects, it is not always clear what may have in common things apparently so different as the water-circulation model of the Mediterranean see, the Ising model of phase transitions and critical states, the cell automata as computer models of the developing of life, the molecular modeling of drug-receptor interactions or DNA-protein recognition processes, and the modeling of inter and intramolecular hydrogen bonding interactions (the subject present chapter is actually devoted to).

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References

  1. H. Primas. “Chemistry, Quantum Mechanics and Reductionism”, Springer-Verlag, Berlin (1983).

    Book  Google Scholar 

  2. K.R. Popper. “The Logic of Scientific Discovery”, Hutchinson, London (1959).

    Google Scholar 

  3. K.G. Wilson, Rev. Mod. Phys. 55:583 (1983).

    Article  Google Scholar 

  4. S.S. Schweber, Physics Today November Issue:34 (1993).

    Google Scholar 

  5. P.W. Anderson, Science 177:393 (1972).

    Article  CAS  Google Scholar 

  6. P.A.M. Dirac, Proc. Roy. Soc. London A123:713 (1929).

    Google Scholar 

  7. H. Primas, J. Math. Biol. 4:281 (1977).

    Article  CAS  Google Scholar 

  8. F.H. Allen, S. Bellard, M.D. Brice, B.A. Cartwright, A. Doubleday, H. Higgs, T. Hummelink, B.G. Hummelink-Peters, O. Kennard, W.D.S. Motherwell, J.R. Rodgers and D.G. Watson, Acta Crystallogr. Sect. B 35:2331 (1979).

    Article  Google Scholar 

  9. F.H. Allen, J.E. Davies, J.J. Galloy, O. Johnson, O. Kennard, C.E. Macrae, E.M. Mitchell, G.E. Mitchell, J.M. Smith and D.G. Watson, J. Chem. Inf. Comput. Sci. 31:187 (1991).

    Article  CAS  Google Scholar 

  10. G. Bergerhoff, R. Hundt, R. Sievers and I.D. Brown, J. Chem. Inf. Comput. Sci. 23:66 (1983).

    Article  CAS  Google Scholar 

  11. L.D. Calvert, Acta Crystallogr. Sect. A 37:C343 (1981).

    Google Scholar 

  12. F.C. Bernstein, T.F. Koetzle, G.J.B. Williams, E.F. Jr. Meyer, M.D. Brice, J.R. Rodgers, O. Kennard, T. Shimanouchi and M. Tasumi, J. Mol. Biol. 112:535 (1977).

    Article  CAS  Google Scholar 

  13. G. Gilli, E. Bellucci, V. Ferretti and V. Bertolasi, J. Am. Chem. Soc. 111:1023 (1989).

    Article  CAS  Google Scholar 

  14. V. Bertolasi, P. Gilli, V. Ferretti and G. GiUi, J. Am. Chem. Soc. 113:4917 (1991).

    Article  CAS  Google Scholar 

  15. G. Gilli, V. Bertolasi, P. Gilli and V. Ferretti, Acta Crystallogr. Sect. B 49:564 (1993).

    Article  Google Scholar 

  16. P. Gilli, V. Ferretti, V. Bertolasi and G. Gilli, A Novel Approach to Hydrogen Bonding Theory, in: “Advances in Molecular Structure Research”, Vol. 2, M. Hargittai and I. Hargittai eds., JAI Press Inc, Greenwich, CT, USA (1995), in the press.

    Google Scholar 

  17. E.R. Lippincott and R. Schroeder, J. Chem. Phys. 23:1099 (1955)

    Article  CAS  Google Scholar 

  18. R. Schroeder and E.R. Lippincott, J. Phys. Chem. 61:921 (1957).

    Article  CAS  Google Scholar 

  19. P. Gilli, V. Bertolasi, V. Ferretti and G. Gilli, J. Am. Chem. Soc. 116:909 (1994).

    Article  CAS  Google Scholar 

  20. V. Bertolasi, P. GiUi, V. Ferretti and G. Gilli, Acta Crystallogr. Sect. B 51: (1995), in the press.

    Google Scholar 

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© 1996 Springer Science+Business Media New York

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Gilli, P., Ferretti, V., Gilli, G. (1996). Hydrogen Bonding Models: Their Relevance to Molecular Modeling. In: Gans, W., Amann, A., Boeyens, J.C.A. (eds) Fundamental Principles of Molecular Modeling. Springer, Boston, MA. https://doi.org/10.1007/978-1-4899-0212-2_7

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  • DOI: https://doi.org/10.1007/978-1-4899-0212-2_7

  • Publisher Name: Springer, Boston, MA

  • Print ISBN: 978-1-4899-0214-6

  • Online ISBN: 978-1-4899-0212-2

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