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"Could an anisotropic molecular mechanics/dynamics potential account for ..."

Krystel El Hage et al. (2013)

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DOI: 10.1002/JCC.23242

access: closed

type: Journal Article

metadata version: 2020-12-29

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Krystel El Hage, Jean-Philip Piquemal, Zeina Hobaika, Richard G. Maroun, Nohad Gresh:
Could an anisotropic molecular mechanics/dynamics potential account for sigma hole effects in the complexes of halogenated compounds? J. Comput. Chem. 34(13): 1125-1135 (2013)

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