Article ID Journal Published Year Pages File Type
5390713 Chemical Physics Letters 2008 5 Pages PDF
Abstract
The IR absorption lineshape of the NH stretching fundamental transition of an adenine:uracil pair in deuterochloroform is obtained combining QM/MM trajectory simulations and a hydrogen bond length-frequency correlation relation.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
QM/MM lineshape simulation of the hydrogen-bonded uracil NH stretching vibration of the adenine:uracil base pair in CDCl3
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