"An ab initio molecular orbital study of intramolecular hydrogen ..."

Zhiwei Liu, Alexey Teslja, Vojislava Pophristic (2011)

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DOI: 10.1002/JCC.21767

access: closed

type: Journal Article

metadata version: 2020-05-30

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Zhiwei Liu, Alexey Teslja, Vojislava Pophristic:
An ab initio molecular orbital study of intramolecular hydrogen bonding in ortho-substituted arylamides: Implications for the parameterization of molecular mechanics force fields. J. Comput. Chem. 32(9): 1846-1858 (2011)

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