Combining Electronic Structure Methods with the Calculation...

Combining Electronic Structure Methods with the Calculation of Hydrogen Vibrational Wavefunctions:  Application to Hydride Transfer in Liver Alcohol Dehydrogenase

Webb, Simon P., Agarwal, Pratul K., Hammes-Schiffer, Sharon
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Volume:
104
Language:
english
Journal:
The Journal of Physical Chemistry B
DOI:
10.1021/jp001635n
Date:
September, 2000
File:
PDF, 200 KB
english, 2000
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