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10 January 2008

Chromatographic Analysis of Environmental and Food Toxicants

Chromatographic Analysis of Environmental and Food Toxicants
Pages: 344


Shows how to choose the most effective techniques for assessing the toxicity of chemicals in both food and the environment. examines a wide range of volatile compounds from toxic aldehydes and pesticides to micotoxins and dioxins.


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Capillary Gas Chromotography in Food Control and Research

Capillary Gas Chromotography in Food Control and Research
Pages: 300


This is a comprehensive presentation of the methods and applications of GC analysis of food, food ingredients (raw materials and additives) and food contaminants. Each chapter is prepared by a specialist in the topic discussed. The new book is designed to serve food analysts and researchers in their practical work. Numerous illustrations give examples of GC output.


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06 January 2008

Computational Quantum Chemistry II

Computational Quantum Chemistry II - The Group Theory Calculator
Pages: 196


 


Modern Computational Quantum Chemistry is indispensable for research in the chemical sciences. Computational Quantum Chemistry II - The Group Theory Calculator describes the group theory that the authors have developed in the past twenty-five years and illustrates how this approach, known as the 'Spherical Shell' method, can be applied to solve a variety of problems that benefit from a group theory analysis.


To complement the theory, the book is supplied with a CD-ROM (Windows ™ application), on which interactive files, based on EXCEL spreadsheet technology controlled by Visual Basic code, can be used to perform straightforwardly group-theory analyses for direct application to the simplification of physical problems in Chemistry, Physics and even Engineering Science.


* A comprehensive description of the authors' revolutionary group theory and structural chemistry methodology
* A unique reference/ teaching work together with a CD-ROM filled with powerful interactive files that can be applied to solve group theory problems
* Valuable companion for instructors, designers and students
* Contains powerful calculators that are simple to use and do not require detailed knowledge for their application


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Computational Materials Science

Computational Materials Science, Volume 15
(Theoretical and Computational Chemistry)
Pages: 472


Computational tools have been permanently deposited into the toolbox of theoretical chemists. The impact of new computational tools can hardly be overestimated, and their presence in research and applications is overwhelming. Theoretical methods such as quantum mechanics, molecular dynamics, and statistical mechanics have been successfully used to characterize chemical systems and to design new materials, drugs, and chemicals. This volume on Computational Material Sciences covers selected examples of notable applications of computational techniques to material science. The chapters contained in this volume include discussions of the phenomenon of chaos in chemistry, reaction network analysis, and mechanisms of formation of clusters. Details of more practical applications are also included in the form of reviews of computational design of new materials and the prediction of properties and structures of well known molecular assemblies. Current developments of effective computational methods, which will help in understanding, predicting, and optimizing periodic systems, nanostructures, clusters and model surfaces are also covered in this volume.


1. Reviews of current computational methods applied in material science
2. Reviews of practical applications of modelling of structures and properties of materials
3. Cluster and periodical approaches


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