Distributions and Averages of Molecular Conformations
نویسنده
چکیده
A computational technique is proposed for the study of electron density variations within a distribution of molecular conformations. These variations are defined in terms of the deviations of individual electron densities from the average density associated with the average of conformations within a conformational range of a molecule.
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عنوان ژورنال:
- Computers & chemistry
دوره 25 1 شماره
صفحات -
تاریخ انتشار 2001