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"Modeling zinc in biomolecules with the self consistent charge-density ..."

Marcus Elstner et al. (2003)

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DOI: 10.1002/JCC.10201

access: closed

type: Journal Article

metadata version: 2023-09-30

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Marcus Elstner, Qiang Cui, Petra Munih, Efthimios Kaxiras, Thomas Frauenheim, Martin Karplus:
Modeling zinc in biomolecules with the self consistent charge-density functional tight binding (SCC-DFTB) method: Applications to structural and energetic analysis. J. Comput. Chem. 24(5): 565-581 (2003)

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