Molecular Modeling Basics Book [PDF] Download

• Publisher : CRC Press
• File Size : 42,8 Mb
• Release Date : 26 April 2010

Molecular modeling is becoming an increasingly important part of chemical research and education as computers become faster and programs become easier to use. The results, however, have not become easier

• Publisher : Walter de Gruyter GmbH & Co KG
• File Size : 44,9 Mb
• Release Date : 17 December 2018

Volume 42 of Reviews in Mineralogy and Geochemistry covers the Applications in the Geosciences via Molecular Modeling Theory. We hope the content of this review volume will help the interested reader

• Publisher : John Wiley & Sons
• File Size : 35,9 Mb
• Release Date : 15 January 2018

A comprehensive yet accessible exploration of quantum chemical methods for the determination of molecular properties of spectroscopic relevance Molecular properties can be probed both through experiment and simulation. This book

• Publisher : Springer Science & Business Media
• File Size : 38,6 Mb
• Release Date : 20 May 2008

The gap between introductory level textbooks and highly specialized monographs is filled by this modern textbook. It provides in one comprehensive volume the in-depth theoretical background for molecular modeling and

• Publisher : CRC Press
• File Size : 45,9 Mb
• Release Date : 30 March 2005

Increasingly useful in materials research and development, molecular modeling is a method that combines computational chemistry techniques with graphics visualization for simulating and predicting the structure, chemical processes, and properties

• Publisher : John Wiley & Sons
• File Size : 45,9 Mb
• Release Date : 05 October 2011

Molecular modeling encompasses applied theoretical approaches and computational techniques to model structures and properties of molecular compounds and materials in order to predict and / or interpret their properties. The modeling

• Publisher : Elsevier
• File Size : 43,5 Mb
• Release Date : 19 October 2001

Understanding Molecular Simulation: From Algorithms to Applications explains the physics behind the "recipes" of molecular simulation for materials science. Computer simulators are continuously confronted with questions concerning the choice of

• Publisher : John Wiley & Sons
• File Size : 41,8 Mb
• Release Date : 17 August 2011

A concise, basic introduction to modelling and computational chemistry which focuses on the essentials, including MM, MC, and MD, along with a chapter devoted to QSAR and Discovery Chemistry. Includes

• Publisher : Elsevier
• File Size : 55,9 Mb
• Release Date : 18 December 2001

In recent years chemical engineers have become increasingly involved in the design and synthesis of new materials and products as well as the development of biological processes and biomaterials. Such

• Publisher : Unknown Publisher
• File Size : 55,7 Mb
• Release Date : 20 May 1998

This book explores the molecular modeling, enabling the nonspecialist to appreciate the power as well as the limitations of the computational tools available and giving a background to the methods