Quantum Modeling of Complex Molecular Systems
商品資訊
系列名：Challenges and Advances in Computational
ISBN13：9783319216256
出版社：Springer Verlag
作者：Jean-Louis Rivail (EDT); Manuel Ruiz-lopez (EDT); Xavier Assfeld (EDT)
出版日：2015/10/28
裝訂：精裝
規格：23.5cm*15.5cm (高/寬)
商品簡介
This multi-author contributed volume includes methodological advances and original applications to actual chemical or biochemical phenomena which were not possible before the increased sophistication of modern computers. The chapters contain detailed reviews of the developments of various computational techniques including: methods adapted to the computation of systems containing hundreds of atoms; advances in hybrid Quantum Mechanical/Molecular Mechanical methods; studies of molecular solids, studies of molecular liquids and solutions and new methodologies, applications in particular to biomacromolecules. Quantum modeling of complex molecular systems is a useful resource for graduate students and fledgling researchers and is also an excellent companion for research professionals engaged in computational chemistry, material science, nanotechnology, physics, drug design, and molecular biochemistry.
作者簡介
Present status: Emeritus Professor of Theoretical Chemistry, University of Lorraine (Nancy Campus).
Research field: Theoretical modeling of complex molecular systems. Publications (more than 200).
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