## Abstract Various quantum mechanical/molecular mechanical (QM/MM) geometry optimizations starting from an xβray crystal structure and from the snapshot structures of constrained molecular dynamics (MD) simulations have been performed to characterize two dynamically stable active site structures o
β¦ LIBER β¦
The structure of Cd sites in metallothioneins studied by combination of XAFS and molecular dynamic
β Scribed by Alexander V. Soldatov; Grigory Smolentsev; Galina Yalovega; Jayna Chan; Martin Stillman
- Book ID
- 108256671
- Publisher
- Elsevier Science
- Year
- 2006
- Tongue
- English
- Weight
- 156 KB
- Volume
- 75
- Category
- Article
- ISSN
- 0969-806X
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