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The metal centers of cytochrome c oxidase: Structure and function

โœ Scribed by Sunney I. Chan; David F. Blair; Craig T. Martin; Hsin Wang; Jeff Gelles; J.E. Morgan; Steve Witt; R.R. Birge; Tom H. Stevens; Gary W. Brudvig


Publisher
Elsevier Science
Year
1983
Tongue
English
Weight
260 KB
Volume
79
Category
Article
ISSN
0020-1693

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## Abstract Reliable atomic point charges are of key importance for a correct description of the electrostatic interactions when performing classical, force field based simulations. Here, we present a systematic procedure for point charge derivation, based on quantum mechanical methodology suited f