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2016

1.

H. Jin; P. Gojal; A. K. Das; M. Gaus; M. Meuwly; Q. Cui

Copper Oxidation/Reduction in Water and Protein: Studies with DFTB3/MM and VALBOND Molecular Dynamics Simulations Journal Article

In: J. Phys. Chem. B, vol. 120, pp. 1894, 2016.

BibTeX | Tags: Copper, DFTB3, Molecular Dynamics, Molecular Mechanics, VALBOND