Rapid Location of the Preferred Interaction Sites between Small Polar Molecules and Macromolecules. II. Binding of Water to a Model Segment of B-DNA

The procedure developed in Part I of this series is applied to the homopolymeric sequences poly(dA) · poly(dT) and poly(dG) · poly(dC) on the double helical structure of B‐DNA. Some aspects of the base sequence influence on the polymer's attraction for water molecule are described. The results...

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Veröffentlicht in:Journal of computational chemistry 1986-10, Vol.7 (5), p.629-639
1. Verfasser: Neto, Marçal De Oliveira
Format: Artikel
Sprache:eng
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Zusammenfassung:The procedure developed in Part I of this series is applied to the homopolymeric sequences poly(dA) · poly(dT) and poly(dG) · poly(dC) on the double helical structure of B‐DNA. Some aspects of the base sequence influence on the polymer's attraction for water molecule are described. The results are used to discuss the general hydration features of those systems in relation to recent experimental studies of DNA single crystals.
ISSN:0192-8651
1096-987X
DOI:10.1002/jcc.540070504