"Solvated ensemble averaging in the calculation of partial atomic charges."

Maral Basma et al. (2001)

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DOI: 10.1002/JCC.1072

access: closed

type: Journal Article

metadata version: 2021-04-09

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Maral Basma, S. Sundara, Dilek Çalgan, Tereza Vernali, Robert J. Woods:
Solvated ensemble averaging in the calculation of partial atomic charges. J. Comput. Chem. 22(11): 1125-1137 (2001)

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