Molecular Modeling and Dynamics of Bioinorganic Systems
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BeschreibungA unique selection of papers on the most recent progress in the modelling of biological molecules containing metal ions. New approaches and techniques in this field are allowing researchers to discuss structures, electronic properties and reaction mechanisms of metalloproteins on the basis of computational studies. The book discusses different approaches in the development of new force fields and their application to the computation of the structures, electronic properties and dynamics of bioinorganic compounds as well as quantum mechanical and integrated QM/MM methods for understanding the function of metalloenzymes and the calculation of electrostatic interactions.
Untertitel: Sprache: Englisch.
Verlag: Springer Netherlands
Erscheinungsdatum: Dezember 2012
Format: pdf eBook
Kopierschutz: Adobe DRM