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This digital document is an article from Chemistry: Foundations and Applications, brought to you by Gale®, a part of Cengage Learning, a world leader in e-research and educational publishing for libraries, schools and businesses.The length of the article is 530 words.The article is delivered in HTML format and is available in your Amazon.com Digital Locker immediately after purchase.You can view it with any web browser.

“Chemistry: Foundations and Application” is an accessible four-volume set that covers chemistry’s laws, processes, applications and sub-disciplines, reviews the history of the field, including modern research and practical applications, and includes biographies of scientists past and present. Varied topics that examine and explain chemistry's many branches, including inorganic, industrial, atmospheric and computational chemistry, and biotechnology allow students and general-interest readers alike to explore the myriad ways in which chemistry plays an important role in daily life.

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This is a bundle that packages the standard 8th edition of Carey's Organic Chemistry (ISBN 007735477X) with A Guide to Framework Molecular Modeling model kit by Stephen D. Darling. Throughout all eight editions, Organic Chemistry has been designed to meet the needs of the "mainstream," two-semester, undergraduate organic chemistry course. This best-selling text gives students a solid understanding of organic chemistry by stressing how fundamental reaction mechanisms function and reactions occur. ... Read more

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This digital document is a journal article from Journal of Hazardous Materials, published by Elsevier in 2007. The article is delivered in HTML format and is available in your Amazon.com Media Library immediately after purchase. You can view it with any web browser.

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Registration, evaluation and authorization of chemicals (REACH) represents a recent regulatory initiative by the European union commission to protect human health and the environment from potentially hazardous chemicals. Under REACH, all stakeholders must submit (thermo)physical, thermochemical, and toxicological data for certain chemicals. The commission's impact assessment studies estimate that the costs of REACH will be approximately 3-5 billion Euros. The present study advocates the systematic incorporation of computational chemistry and computer-assisted chemical risk assessment methods into REACH to reduce regulatory compliance costs. Currently powerful computer-aided ab initio techniques can be used to generate predictions of key properties of broad classes of chemicals, without resorting to costly experimentation and potentially hazardous testing. These data could be integrated into a centralized IT decision and compliance support system, and stored in a retrievable, easily communicable manner should new regulatory and/or production requirements necessitate the introduction of different uses of chemicals under different conditions. For illustration purposes, ab initio calculations are performed on heterocyclic nitrogen-containing compounds which currently serve as high energy density materials in the chemical industry. Since investigations of these compounds are still in their infancy, stability studies are imperative regarding their safe handling and storage, as well as registration under REACH. ... Read more

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This digital document is an article from Bioinformation, published by Biomedical Informatics Publishing Group on January 1, 2008. The length of the article is 2391 words. The page length shown above is based on a typical 300-word page. The article is delivered in HTML format and is available immediately after purchase. You can view it with any web browser.

From the author: Keywords: TSR domain; R-spondin 4; heparin binding; molecular modelling

Citation Details
Title: Molecular modeling of the TSR domain of R-spondin 4.(Hypothesis)
Author: Leila Ayadi
Publication: Bioinformation (Magazine/Journal)
Date: January 1, 2008
Publisher: Biomedical Informatics Publishing Group
Page: 119(5)

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Molecular Modeling is a powerful tool of computational chemistry and is widely used in many research areas, such as drug design or biotechnology. This volume publishes in printed form all articles on the subject published by the Journal of Molecular Modeling during 1995 online in the Internet. The printed version guarantees easy access to all articles without connecting to Internet; the accompanying CD delivers all articles including colour prints in postscript format and supplemental material not available online. ... Read more

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Molecular Modeling is a powerful tool of computational chemistry and is widely used in many research areas, such as drug design or biotechnology. This volume publishes, in printed form, all articles on the subject published by the Journal of Molecular Modeling online in the Internet during 1996 . The printed version guarantees easy access to all articles without connecting to Internet; the accompanying CD delivers all articles including the multimedia applications and supplementary material not available online. ... Read more

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technical book regarding heterogeneous catalysis ... Read more

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Molecular Modeling Using ChemOffice features a series of 20 exercises that are designed to help guide students through the use of ChemDraw and Chem3D, to the point of developing a basic understanding of molecular mechanics. After students are taught the foundation for drawing molecules with ChemOffice, they are given a series of exercises and problems. These exercises relate to such topics as: molecular mechanics, the effect stretching, bending and twisting has on a molecule's stability, reaction mechanisms, stereochemistry, spectroscopy, and special topics such as polymers, biomolecules and symmetry. ... Read more

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Ionic liquids (ILs) are an exciting class of compounds with unique propertiesthat make them attractive for industrial applications. Among their valuablefeatures, an immesurably low vapor pressure and a liquid state at or nearambient conditions are found at the top of the list. In this book,thermophysical and transport properties of ionic liquids are theoreticallyinvestigated by means of molecular simulation techniques. Quantum calculationsare used as a supportive tool to force field development work. This researchtask is guided and supported by experimental studies. Studied cations include imidazolium-, pyridinium- andtriazolium-based structures with different inorganic anions such as hexafluorophosphate,bis(trifluoromethanesulfonyl)imide, nitrate and perchlorate. Static propertiescomputed include gravimetric densities, volumetric expansivities, isothermalcompressibilities, heat capacities, cohesive energy densities as well as the liquidstructure. Analysis of the dynamic properties of ionic liquid systems is also carriedout yielding information on the rotational dynamics and transport properties. ... Read more

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This workbook with CD features SpartanViewTM and SpartanBuildTM software. It includes a software tutorial and numerous challenging exercises that readers can tackle to solve problems involving structure building and analysis, using the tools included in the two pieces of Spartan software. Included are the molecular model files for the activities. Free when packaged with selected Pearson textbooks.


A useful workbook for chemistry courses.

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