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"Accuracy and tractability of a kriging model of intramolecular polarizable ..."

Shaun M. Kandathil et al. (2013)

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DOI: 10.1002/JCC.23333

access: closed

type: Journal Article

metadata version: 2020-06-15

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Shaun M. Kandathil, Timothy L. Fletcher, Yongna Yuan, Joshua D. Knowles, Paul L. A. Popelier:
Accuracy and tractability of a kriging model of intramolecular polarizable multipolar electrostatics and its application to histidine. J. Comput. Chem. 34(21): 1850-1861 (2013)

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