"Natural bond orbital analysis in the ONETEP code: Applications to large ..."

Louis P. Lee et al. (2013)

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DOI: 10.1002/JCC.23150

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type: Journal Article

metadata version: 2020-04-01

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Louis P. Lee, Daniel J. Cole, Mike C. Payne, Chris-Kriton Skylaris:
Natural bond orbital analysis in the ONETEP code: Applications to large protein systems. J. Comput. Chem. 34(6): 429-444 (2013)

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