Concepedia

Density functional theory investigations of NiN2S2 reactivity as a function of nitrogen donor type and N–H···S hydrogen bonding inspired by nickel-containing superoxide dismutase

Christopher S. Mullins, Craig A. Grapperhaus, Pawel M. Kozlowski

JBIC Journal of Biological Inorganic Chemistry · 2006 · 43 citations · 42 references

DOI

Concepts

References

42

Voronoi deformation density (VDD) charges: Assessment of the Mulliken, Bader, Hirshfeld, Weinhold, and VDD methods for charge analysis

Célia Fonseca Guerra, Jan‐Willem Handgraaf, Evert Jan Baerends et al. · Journal of Computational Chemistry · 2003 · 1.2K citations

, , +16

MOLEKEL: An Interactive Molecular Graphics Tool

Stefan Portmann, Hans Peter Lüthi · CHIMIA International Journal for Chemistry · 2000 · 853 citations · Full text

, , +13

Hydrogen Bonding in Solids

G. Wilkinson · Physics Bulletin · 1968 · 722 citations

, , +13

Nickel Superoxide Dismutase Structure and Mechanism

D.P. Barondeau, C.J. Kassmann, C.K. Bruns et al. · Biochemistry · 2004 · 412 citations

, , +17

Crystal structure of nickel-containing superoxide dismutase reveals another type of active site

Jochen Wuerges, Jin‐Won Lee, Yang-In Yim et al. · Proceedings of the National Academy of Sciences · 2004 · 352 citations

, , +12