Quantum Simulations of Materials and Biological Systems (Paperback, 2012 ed.)

Quantum Simulations of Materials and Biological Systems features contributions from leading world experts in the fields of density functional theory (DFT) and its applications to material and biological systems. The recent developments of correlation functionals, implementations of Time-dependent algorithm into DFTB+ method are presented. The applications of DFT method to large materials and biological systems such as understanding of optical and electronic properties of nanoparticles, X-ray structure refinement of proteins, the catalytic process of enzymes and photochemistry of phytochromes are detailed. In addition, the book reviews the recent developments of methods for protein design and engineering, as well as ligand-based drug design. Some insightful information about the 2011 International Symposium on Computational Sciences is also provided. Quantum Simulations of Materials and Biological Systems is aimed at faculties and researchers in the fields of computational physics, chemistry and biology, as well as at the biotech and pharmaceutical industries.

General

Imprint:	Springer
Country of origin:	Netherlands
Release date:	August 2014
First published:	2012
Editors:	Jun Zeng • Ruiqin Zhang • Herbert Treutlein
Dimensions:	235 x 155 x 11mm (L x W x T)
Format:	Paperback
Pages:	198
Edition:	2012 ed.
ISBN-13:	978-9400794122
Categories:	Books > Science & Mathematics > Physics > General Books > Science & Mathematics > Mathematics > Applied mathematics > General Books > Science & Mathematics > Chemistry > Physical chemistry > Quantum & theoretical chemistry Books > Science & Mathematics > Biology, life sciences > Biochemistry > General Books > Professional & Technical > Mechanical engineering & materials > Materials science > General Promotions
LSN:	9400794126
Barcode:	9789400794122

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