Molecular Modeling and Dynamics of Bioinorganic Systems

Peter Comba

ISBN 10: 9401061742 / ISBN 13: 9789401061742

Edité par Springer Netherlands, 2012

A propos de cet article

Druck auf Anfrage Neuware - Printed after ordering - 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.

N° de réf. du vendeur 9789401061742

Détails bibliographiques

• Titre: Molecular Modeling and Dynamics of Bioinorganic Systems
• Éditeur: Springer Netherlands
• Date de parution: 2012
• Langue: anglais
• ISBN à 10 chiffres: 9401061742
• ISBN à 13 chiffres: 9789401061742
• Reliure: Taschenbuch
• État de l'article: Neu

A propos de ce titre

Synopsis

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.