Quantum algebraic–combinatoric study of the conformational properties of n-alkanes. II.

Tasi, Gyula and Mizukami, F. and Csontos, József and Győrffy, W. and Pálinkó, István (2000) Quantum algebraic–combinatoric study of the conformational properties of n-alkanes. II. JOURNAL OF MATHEMATICAL CHEMISTRY, 27 (3). pp. 191-199. ISSN 0259-9791

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Abstract

In a previous paper we solved a well-defined subcase of the whole conformational enumeration problem of n-alkanes. This paper offers a general solution. Most probably the rules determining the sequences of the conformers slightly depend on the force field applied. Nevertheless, the methods presented here can be applied in every case.

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