Molecular Modeling and Dynamics of Bioinorganic Systems
Ivano Bertini, Antonio Rosato (auth.), Lucia Banci, Peter Comba (eds.)A 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.
种类:
年:
1997
出版:
1
出版社:
Springer Netherlands
语言:
english
页:
470
ISBN 10:
9401151717
ISBN 13:
9789401151719
系列:
NATO ASI Series 41
文件:
PDF, 21.75 MB
IPFS:
,
english, 1997
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