The Impact of Stereochemistry on Drug Development and Use

Book Description

Provides an authoritative source of practical information on stereochemistry and its impact on drug development. Unlike other books which focus on synthesis, this work explores analytical, pharmacological, and regulatory topics in dealing with the theory and practice of stereochemistry in the pharmaceutical industry today. It specifically addresses how the body metabolizes chiral molecules; the varying effects of different chiral molecules; and provides detailed evaluations of current seperation techniques. Includes regulatory information.

Average customer rating:

Not so good
Instrumental text book review
alternatives to this book
So disorganized a book that it hurts
Style of writing is painful

Principles of Instrumental Analysis
Douglas A. Skoog , F. James Holler , and Stanley R. Crouch
Manufacturer: Brooks Cole
ProductGroup: Book
Binding: Hardcover

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ASIN: 0495012017

Book Description

PRINCIPLES OF INSTRUMENTAL ANALYSIS places an emphasis on the theoretical basis of each type of instrument, its optimal area of application, its sensitivity, its precision, and its limitations.You'll also learn about elementary analog and digital electronics, computers, and treatment of analytical datA. Visit the book companion website for tutorials on instrumental methods, Excel files of data analysis and simulations of analytical techniques to help you visualize important concepts in this course, and selected papers from the chemical literature to stimulate interest and provide background information for study.

Customer Reviews:

Not so good.......2007-09-18

I have to use this textbook for one of my classes, and I must say, it is horrible. The examples for problems in the book hardly give any explanation of what they are doing. The questions at the end of the chapter are very difficult and looking back at the chapter just makes the question even more confusing. I like to use textbooks when I do not understand what is going on in my class, but this one does not help at all! I think the only way you can understand this book is if you are already well educated in the course. Everytime I am assigned problems in the book, I cringe, because I know I am going to be spending hours being more confused than I have ever been in my life.

Instrumental text book review.......2007-07-20

This book covers the basics of instrumental analysis well. This is not a book for someone who needs colored illustrations and flashy pictures. The key words do not jump out of the page like many of the new undergraduate text books. The text is to the point. As with any textbook, there are some minor errors, but this book is better than some others I've encountered.

alternatives to this book.......2007-03-09

I'm not sure why there are so many negative reviews of this book. I found it to be very solid.

For those of you who don't like it you have 3 options:

either "Instrumental Methods of Analysis" by Willard, Merritt, Dean, Settle; (ISBN 0534081428) which is excellent and a true classic.

or "Chemical Analysis: Modern Instrumentation Methods and Techniques" by Francis Rouessac & Annick Rouessac

or "Chemical Instrumentation: A Systematic Approach" by Strobel and Heineman. This book, however, is very hardware oriented and not a general instrumental analysis text.

I would also recommend that you buy "Statistics and Chemometrics for Analytical Chemistry" by James N. Miller & Jane C. Miller. It does a much better job than the cursory chapters found in regular analytical texts. Get the 4th or 5th edition. For a paperback, this book is ridiculously expensive if you buy new. Try to find a used copy.

While the book by Miller & Miller is good, it's no substitute for a 1 or 2 semester course in stats. A good book for this material might be Statistics for Research, Third Edition by Shirley Dowdy, Stanley Wearden, Daniel Chilko (ISBN 047126735X)

Check out my other reviews for other undergrad. chem books.

So disorganized a book that it hurts.......2005-12-24

There is no clear organization in this book. Seems like they took many papers and at random picked paragraphs out of them. The only place they show organization is when they are introducing stuff in a chapter.
Works as a reference book because you can look in the back and find the 6 or seven places your topic of interest is scattered in the book. but in general the gain of knowledge through the organization of this book is near to impossible.
The authors of this book should be ashamed of themselves for doing such harm to Chemistry students.

Style of writing is painful.......2005-09-02

Just start reading the introduction, or flip to anywhere in this book to see all you need to know about it's readability: a bit rough to say the least.

For example, in the introduction, the concept of carrying binary data in a shorter period of time on a wire than several measured pulses was presented in such a confusing manner that I was forced to read it 4 times to understand what was already a simple and understood concept to me. The excessive formality of this book is a killer.. It reads at times like a formal mathematics proof book, however, at other times it is a bit more readable.

Like people said.. use this for reference.. not for a textbook.

Average customer rating:

Excellent Text on Analytical Chemistry
most student friendly of all the analytical chem books
Why can't all chem books be like this?
Just About Identical as the 6th edition
Textbook case

Quantitative Chemical Analysis
Daniel C. Harris
Manufacturer: W.H.Freeman & Co Ltd
ProductGroup: Book
Binding: Hardcover

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ASIN: 0716776944

Customer Reviews:

Excellent Text on Analytical Chemistry.......2007-06-03

This review refers to the fourth edition of this book.
I bought this book at the Stanford University Bookstore as a reference text for quantitative analytical chemistry. Overall, I'd say it's an excellent book which covers all the fundamentals of the subject. It also contains a great deal of useful data. The editing is excellent (I didn't notice any typos) and so are the graphics (tables, charts, pictures).
Mind you, this subject is so big that only a small fraction can be covered even in a large tome like this. But the author has used the space available to him well.

I note that the reviewers who do not like this book seem to be students while those who love it are teachers or experienced engineers (like myself). I suppose that means that the author is assuming a certian level of knowledge on the part of his readers and is not spending a large amount of time explaining basic concepts.

most student friendly of all the analytical chem books.......2007-04-16

So, you're considering either buying or adopting this text for intro analytical chemistry? Good choice!

This is the easiest, most straightforward, book on the market for students. It's been that way through many editions. It was a breath of fresh air (in comparison to Skoog) when it was first published.

Your other choices are "Fundamentals of Analytical Chemistry" by Skoog et al.(ISBN 0534417965) and "Analytical Chemistry" by Gary D. Christian (ISBN 0471214728).

Skoog is good it's just that he can't match Harris for clarity.

Christian doesn't change much. The end-of-chapter problems are usually just re-numbered. It's OK, though.

Fortunately, whichever you choose, none can be considered deficient.

One thing I don't like about these intro books: Why do they include all this instrumental analysis material? The instrumental analysis texts do a better job with these subjects anyway and all the extra chapters make the books needlessly heavy.

The intro books should just focus on basics like acid/base/complexometric/redox titrations, gravimetric analysis, sample prep., extractions, etc.

Harris (along with Bertolucci) has also written a true classic in the field of molecular spectroscopy: "Symmetry and Spectroscopy: An Introduction to Vibrational and Electronic Spectroscopy". Get that, too.

Check out my other reviews for other chem books

Why can't all chem books be like this?.......2006-12-20

The explanations and reasoning behind doing certain procedures and calculations in this book is outstandingly good (most of the time). Each chapter provides detailed workthroughs of problems with easy to understand explanations and in a wide enough variety of ways for one to be able to do most of the problems in the back of the chapter without TOO much trouble. The life saver though is the separate optional solutions manual which provides ALL of the answers (even stepwise) to the chapter problems (GET THIS BOOK!). The chapters involving instrumental analysis could use some improvement in clarity, but the other chapters are very well written.

Just About Identical as the 6th edition.......2006-12-12

I just took a class that required this textbook, and I used the 6th edition instead of the 7th, and there was only one difference.... in the 6th edition, 2 topics were seperated into 2 different chapters, and in the 7th the two topics were combined into one chapter... If your a student and need this book for class, save yourself some money and buy the 6th edition. The word and homework problems are identical.

Textbook case.......2006-11-12

Item was delivered quickly and in very good condition. No problems were experienced. Good job and thanks.

Synthesis and Applications of Isotopically Labelled Compounds, Volume 7

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Synthesis and Applications of Isotopically Labelled Compounds, Volume 7

Manufacturer: John Wiley & Sons
ProductGroup: Book
Binding: Hardcover

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Book Description

This outstanding book covers the most recent advances in the production of stable and radioactive isotopes as well as in the synthesis, analysis and applications of isotopically labelled compounds. Written by internationally renowned contributors, it provides authoritative and wide-ranging coverage of significant growth areas including:

new methodologies in the production of isotopes
novel approaches to compounds labelled with isotopes of hydrogen, carbon and other stable, long-lived and short-lived radioactive isotopes
advances in the analysis of istopically labelled compounds
recent and future applications of isotopes in pharmaceutical research and development, in pharmacological and clinical sutdies and nuclear medicine, as well as in agricultural, nutritional and environmental research
recent applications of isotopes in investigating organic and bioorganic mechanisms and pathways
safety and regulations of handling isotopes

This will be an invaluable information and reference source to anyone involved in the production of isotopes, the synthesis and analysis of compounds labelled with stable, long-lived or short-lived radioactive isotopes, in drug research and development, in clinical investigations and nuclear medicine, in agricultural research and development and environmental investigations, in the elucidation of biological and chemical pathways, handling radioisotopes, laboratory design and other areas.

Average customer rating:

Not quite comprehensive
Great Analytical Chem book/Chem ref
What do you expect?
Correct book; wrong format
kinda confusing, okay overall

Exploring Chemical Analysis
Daniel C. Harris
Manufacturer: W. H. Freeman
ProductGroup: Book
Binding: Paperback

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ASIN: 0716705710

Customer Reviews:

Not quite comprehensive.......2006-08-04

For the topics this book covers, it does so well. This includes MS, IR, titrations, etc... However, as one being trained as an analytical chemist (specifically mass spectrometrist), I feel compelled to note the complete absence of NMR material in the text. I consider NMR one of the most powerful analytical tools at a chemist's disposal. Hence, this text is good for those being introduced to analytical chem, but not for those looking for further study.

Great Analytical Chem book/Chem ref.......2006-03-02

This book was a required text for my analytical chemistry class. I was at first a bit worried about it, I tend to be picky about chemistry textbooks, but I quickly fell in love with this one. The chapters are short and to the point (most between 20 and 30 pages). Harris tells you what you need to know and gives some good examples in those 20 pages. Other books I have had to use took in excess of 50 pages to describe what Harris does (much better at that) in under 30. This is a nice feature for the time pressured college student.

The formating is also really nice. At the end of each chapter, all of the equations discussed are printed with text telling what each variable is. This is nice for when working on problem sets as you don't have to flip throughout the chapter trying to find one relationship and then search for an hour finding out what each variable means (We all forget at least once). It also makes studying for the exams easier and proofing notes to make sure you have the right equations has never been easier.

The book is directed at either a chem or non-chemistry student. At most schools analytical is low enough to get non-chemistry or even science majors in it. This book walks this line rather well. It doesn't bore the students that are "really excited" about chemistry and it doesn't confuse the "normal" kids. It is easy to read and also, like mentioned before, has little jokes in it.

A few other minor things I liked were the sections on statstical analysis and the paper on which it was printed. I took a stats 100 level class while in highschool and I knew most of the stuff still. However, some parts I forgot and had to relearn. I had to do it for bio and for chem, the bio book and prof made it so boring and drawn out. Harris, on the other hand, jumps into it and makes math and stat analysis, almost, fun. The most minor of my comments is about the paper the book is printed on. A lot of textbooks are printed on overly gloss paper and filled with "look at this picture" images. Harris has color plates, but the majority of the book is composed of greens and blacks. The paper isn't glossy and light doesn't glare on it. This just makes the sitting down and reading part much easier on the eyes.

I would recommand this text for someone wanting to brush up on analytical chemistry, or even just general chemistry. I, as well as most of my peers, intend to keep it as a reference book because it is so well formated and written. In that way, it is almost hard to outgrow.

What do you expect?.......2005-10-01

This is an analytical chemistry textbook, not exactly the most thrilling of chemical disciplines. (unless you are an analytical chemist). It explains things fairly well, and the problems are at the end of the chapters are pretty similar to what you would find on the ACS test for analytical chemistry. The author has a sense of humor and randomly inserts jokes in some of the material. I believe this is the most popular of textbooks for analytical/quantitative chemistry courses.

Correct book; wrong format.......2005-09-29

The book is the right one I needed for class. There is, however, an issue with the book's description on the website - it is listed as hardcover, when in fact it is paperback.

kinda confusing, okay overall.......2004-05-14

i read this book for a chemistry class, and although it was usually fairly clear, which helped a lot, at times the author broke into the first person and started making jokes in the text, which really bugged me. additionally, the examples of problems in the text were usually much easier than the problems at the end of the chapters, so since i couldn't look in the text for help, i was often stumped.
additionally, the text sometimes asked the reader questions like "why does this happen," without providing the answer anywhere. if you didn't know the answer, you obviously weren't gonna learn it, and as a busy college student, i wasn't gonna spend fifteen minutes looking up the answer to these minor questions that should have just been answered in sentence form, as this is a textbook, after all, not a test. my teacher provided those, and thats why i need the text book.
all in all, the book was usually clear, which i liked, but it had some structural faults i didn't.

Analytical Chemistry in a GMP Environment: A Practical Guide

Average customer rating:

A "real" practical book

Analytical Chemistry in a GMP Environment: A Practical Guide
Jim Miller
Manufacturer: Wiley-Interscience
ProductGroup: Book
Binding: Hardcover

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ASIN: 0471314315

Book Description

How to hone your analytical skills and obtain high-quality data in the era of GMP requirements
With increased regulatory pressures on the pharmaceutical industry, there is a growing need for capable analysts who can ensure appropriate scientific practices in laboratories and manufacturing sites worldwide. Based on Johnson & Johnson's acclaimed in-house training program, this practical guide provides guidance for laboratory analysts who must juggle the Food and Drug Administration's good manufacturing practices (GMP) rules with rapidly changing analytical technologies. Highly qualified industry experts walk readers step-by-step through the concepts, techniques, and tools necessary to perform analyses in an FDA-regulated environment, including clear instructions on all major analytical chemical methods-from spectroscopy to chromatography to dissolution. An ideal manual for formal training as well as an excellent self-study guide, Analytical Chemistry in a GMP Environment features:
* The drug development process in the pharmaceutical industry
* Uniform and consistent interpretation of GMP compliance issues
* A review of the role of statistics and basic topics in analytical chemistry
* An emphasis on high-performance liquid chromatographic (HPLC) methods
* Chapters on detectors and quantitative analysis as well as data systems
* Methods for ensuring that instruments meet standard operating procedures (SOP) requirements
* Extensive appendixes for unifying terms, symbols, and procedural information

Customer Reviews:

A "real" practical book.......2004-07-01

This is the book if you work in the analytical lab of pharmaceutical industry. The book covers a lot of practical and day to day problems faced by persons working in the analytical lab especially from a regulatory point of view. Different chapters have been written by area experts making it very useful and comprehensive. I strongly recommend this book.

Fundamentals of Analytical Chemistry (with CD-ROM and InfoTrac )

Average customer rating:

all formula, no concept
Not worth the $ and frustration
Work carefully and check the author's math if perplexed
A great book
this book sucks.

Fundamentals of Analytical Chemistry (with CD-ROM and InfoTrac )
Douglas A. Skoog , Donald M. West , F. James Holler , and Stanley R. Crouch
Manufacturer: Brooks Cole
ProductGroup: Book
Binding: Hardcover

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ASIN: 0030355230

Book Description

FUNDAMENTALS OF ANALYTICAL CHEMISTRY, EIGHTH EDITION is known for its readability combined with a systematic, rigorous approach that characterizes this classic text. Extensive coverage of the principles and practices of quantitative chemistry ensures suitability for chemistry majors. These award-winning authors include applications throughout industry, medicine, and all the sciences. The text's new design and wealth of new photographs by renowned chemistry photographer Charlie Winters serve to reinforce student learning through dynamic visuals. Reflecting the increased emphasis of spreadsheets as a tool in analytical chemistry, this new edition adds an additional chapter, new problems and a new supplement, EXCEL® APPLICATIONS FOR ANALYTICAL CHEMISTRY, that integrate this important aspect of the study of analytical chemistry into its already rich pedagogy. In addition, the INTERACTIVE ANALYTICAL CHEMISTRY CD-ROM, packaged FREE with every new text, enhances conceptual understanding through hands-on integrated multimedia interactivity.

Customer Reviews:

all formula, no concept.......2007-07-09

My complaints about this book have been covered in other reviews but I wanted to add my low-star rating. The Henderson-Hasselbalch equation is given one paragraph of space which refers back to four other equations in the text. Understanding the use of this popular equation requires a convoluted page-flipping to try to work through the author's many equations leading up to it. (And by leading up, I do not mean to imply there's a logical conceptual sequence.) As others have written, the chapter review questions aren't covered adequately in the text and the questions themselves aren't always clear. The Solutions Manual for the text is worthless, tossing out more equations and giving no indications of where the numbers used come from. If you're a professor looking at this book for a class, please keep looking. This isn't the book students need.

Not worth the $ and frustration.......2005-07-23

I returned to college to further my education this year after working as a High School Chemistry and Biology teacher for the last 5 years, and your text "Fundamentals of Analytical Chemistry (with CD-ROM and InfoTrac) 8th Edition" is the required text that we are using for my Quantitative Analysis course. Myself and numerous other students in the class have found ourselves completely exasperated with the text for numerous reasons. Some of the reasons are as follows:

1. Formulas written incorrectly, while the definition/derivation is written properly right next to it, or vice versa.
2. Incorrect answers to the end of the chapter questions given in the back of the book.
3. The end of the chapter questions will often have no previous examples shown in the chapter, or in the chapters prior to it. Essentially there is no guide or basis to begin a question.
4. Asking for something in a way that is so convoluted that one has no idea what is being asked.
5. Suddenly using or asking for a term that has never been used in the book. Such as asking for "molar solubility"...nothing in text as to referred, nothing in the index, and nothing in the glossary.
6. Your solved examples within the chapter are atrocious, in that they are of virtually no use when trying to use them as a guide to the end of the chapter questions. And thank you for skipping/not showing steps or assuming things in the problems when they are shown.

These are great given that one comes to consider the questions, Did I make an algebraic error in solving? Was the formula given the correct one, and was it even given correctly? Did I do it correctly, and is it just the wrong answer given in the back of the text?

I have taken into consideration that I have been out of school for a while and that I may not be as sharp as I used to as far as some of the more complicated calculations, because I have not had much practice recently, however, when one is trying to learn from a book that makes it so hard to do anything with it, it makes it about as useful as a paperweight, which is about the best use I have for it now. A $100+ paperweight.

I thought that the mistakes were due to an early edition text, but with a simple view of the front of this book one can readily see that this is the 8th edition...the EIGHTH edition! One would think that after writing the same book 8 times, these errors and some general refinements may have taken place; thank you for the exception to the rule.

In all my years of school, I have come across many books, both used to learn from as well as ones to teach from, and I have never found a more poorly done text.

We, the students and professor, have created a website solely dedicated to the errors or oddities that we have so far found in the text: Needless to say, it continues to grow.

I will say that it is nice to see you incorporating Excel and other software into the text, which is beneficial in its use in Industry and presentation.

Thought you might want to know...thanks.

Work carefully and check the author's math if perplexed.......2005-05-26

Overall, the book is average. Towards the end when you start reviewing different techniques like voltammetry, potentiometry, spectrometry, and seperations the author explains the material fairly well (and has the least in text problems). I noticed a lot of errors in the book for the in text examples so be careful when checking your answer. I bought the solutions manual to this book and a couple of questions in the manual actually stated that the answers in the back of the book were incorrect. Be very careful from chapters 9-20, as I noticed a few examples had math errors. Also, at least for me, the mathmatics were derived, but not explained as to understand why they add a new term or perform an operation. I would have liked to see them relate the math to the concept better than they did. If you sit with this book (I mean really sit with it) you'll do fine. This is not a text nor a course that you can cram for. It has to be studied everyday of the week.

A great book.......2005-01-01

I used this book in my undergrad Analytical Class. I sold it back at the end of the semester and have wished I hadn't for the last eight years. It is well thought out and easy to navigate when a quick answer is needed once you are out in the "real world". There are some mistakes, like any textbook, but I think the other reviewers are just frustrated crammers sending out late-night rants.

this book sucks........2004-10-07

I am just sitting here reading this book, studying for a huge exam tomorrow morning, and I am just getting so incredibly frustrated with this book and decided that I should let it out on here. Oh my God, there is a mistake on like every friggin page... and to make matters worse, all the mistakes are right smack-dab in the middle of an example problem. So there you are, trying to learn how to work certain problems, and all of a sudden, there's something that just doesnt seem to make any sense. And the whole time you're thinking that you're stupid and you just cant figure out the correct way to do the problem, until a wasted-hour later, you finally realize... "oh, its just ANOTHER stupid mistake these idiots made, and i thought i was retarded." Grrrr, this is killin me. I cannot freakin believe that they could actually charge $140.00 for a book no one even bothered to proofread. okay, so point of the story is... this book sucks, dont buy it if you can get around it, i'd recommend.

Average customer rating:

Excellent book for an early grad student
Very reader friendly NMR textbook

Understanding NMR Spectroscopy
James Keeler
Manufacturer: Wiley
ProductGroup: Book
Binding: Paperback

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ASIN: 0470017872

Book Description

Understanding NMR Spectroscopy

James Keeler Department of Chemistry, University of Cambridge, UK

This text discusses the high-resolution NMR of liquid samples and concentrates exclusively on spin-half nuclei (mainly 1H and 13C). It is aimed at people who are familiar with the use of routine NMR for structure determination and who wish to deepen their understanding of just exactly how NMR experiments work. It demonstrates that in NMR it is possible, quite literally on the back of an envelope, to make exact predictions of the outcome of quite sophisticated experiments. The experiments chosen are likely to be encountered in the routine NMR of small to medium-sized molecules, but are also applicable to the study of large biomolecules, such as proteins and nucleic acids.

The book starts off at a gentle pace, working through some more-or-less familiar ideas, and then elaborating these as the book progresses. Each chapter ends with exercises which are designed to assist in the understanding of the ideas presented and to grasp the underlying ideas.

Customer Reviews:

Excellent book for an early grad student.......2007-08-21

Keeler's book is a very clear exposition of the physical basis and quantum mechanical underpinnings of modern NMR experiments. Because it is fundamentally based on the quantum mechanics, it is, I feel, a better introduction to heteronuclear NMR than the popular book by Claridge. At the same time, Keeler avoids the dense pages of mathematics that can make Cavanagh et al.'s excellent book intimidating to students who are not experts on quantum mechanics. An additional plus for me was Keeler's refreshingly clear description of the physical origins of T2 relaxation.

At the same time, there are some deficiencies here. Keeler does not go into chemical exchange effects in any depth, and I do not believe he mentions REX at all. There is also no discussion of residual dipolar couplings, the model-free dynamics formalism, or diffusion experiments. Pulsed-field gradients and phase-cycling are presented almost as an afterthought. The discusisons of coherence order and raising/lowering operators leave something to be desired and the later chapters in which they appear are structured awkwardly. Keeler deals exclusively with dipolar systems in liquids, limitations that may make this text inappropriate for some labs.

That said, for someone who's had some exposure to NMR (in, say, an organic chemistry course) this is an excellent, clear tour of some theoretical NMR basics that can provide a useful framework for approaching more comprehensive texts. Graduate students without a stong background in physical chemistry who intend to perform advanced work in NMR may find this book particularly helpful.

Very reader friendly NMR textbook.......2006-05-30

Dr. Keeler's is called "Understanding NMR spectroscopy", and that is exactly what it will help you do. He makes very few assumptions about previous knowledge of math and quantum physics. He explains abstract concepts using good analogies. I have tried to read multiple NMR textbooks, and this is by far the most readable... Excellent work Dr. Keeler.... However you should realise what this book is NOT. It is not about how to record and analyze NMR data and it is not an advanced textbook, but aimed for people new to the field with need to understand how an NMR experiment works.

Average customer rating:

Not a good book
You can not expect that much from this book
Worthwhile purchase
A nice book
Introduction to Computational Chemistry

Introduction to Computational Chemistry
Frank Jensen
Manufacturer: Wiley
ProductGroup: Book
Binding: Paperback

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ASIN: 0470011874

Book Description

Introduction to Computational Chemistry Second Edition provides a comprehensive account of the fundamental principles underlying different methods, ranging from classical to the sophisticated. Although comprehensive in its coverage, this textbook focuses on calculating molecular structures and (relative) energies and less on molecular properties or dynamical aspects. No prior knowledge of concepts specific to computational chemistry are assumed, but the reader will need some understanding of introductory quantum mechanics, linear algebra, and vector, differential and integral calculus.

Customer Reviews:

Not a good book.......2006-04-18

I'm a practicing quantum chemist and I own this book, Levine, Szabo, Helgaker, etc. This is by far the worst book for many reasons. First, this book is not pedagogical, you will not learn HOW anything works, just what Jensen or common knowledge says about different methods. Second, Jensen isn't a very good quantum chemist and he's flat out wrong in some places. His remarks on relativistic effects in quantum chemistry elicited a "that's f***ing b***s**t" from an expert in relativistic quantum chemistry I know.

If you want to learn the basics of the methods, Levine, Szabo and Helgaker are the best, in order of difficulty, although review articles (free to academics) and lecture notes found on UGeorgia's CCC home page by David Sherrill are just as good for no cost. I have heard Cramer does a better job at the goal of this book, however, there's no point to writing these quasi-undergraduate textbooks since they aren't classroom-worthy, nor are they useful to any real researcher in the field.

Because one might not care for my review, here is a review in one of the foremost journals in chemistry:

Angewandte Chemie, Int. Ed., September 1999

The large and continually increasing importance of theoretical methods in the solution of chemical problems was impressively documented last year by the conferring of the Nobel price for chemistry on two extraordinary champions of this genre, John Pople and Walter Kohn. Of course, the appearance of Frank Jensen's textbook about computational chemistry could hardly have been better timed. In contrast to the numerous quantum-chemistry textbooks previously available, this book intends to cover the entire field of computational chemistry, although the main emphasis is clearly on the discussion of quantum-mechanical methods.

Jensen begins with an introductory, barely 50 page chapter about empirical force field methods. As in the rest of the book, the aspects being discussed are pleasantly geared toward the requirements of the potential user. In this manner, different parameterization strategies are discussed, and popular force fields are critically examined with regard to their fields of application and are compared to each other. Additional, modern approaches such as the determination of transition structures through force field calculations or the combination of force field methods with quantum-chemical strategies are introduced. Chapters follow in which a conventional, if also state of the art, introduction to the predominant tools of quantum chemistry - the Hartree-Fock approximations, important semiempirical methods (from the H?ckel model to PM3 and SAM1_, and current methods for the inclusion of electron correlation (configuration interaction, perturbation theory, coupled cluster) - is given. These sections are sensibly supplemented by a chapter dedicated to the different basis sets and their characteristics, in which extrapolation methods such as the different Gaussian-1 and -2, CBS, or PCI-X methods are also included. A modern theoretical textbook can naturally not be without a chapter about density functional theory, so their fundamentals and popular functionals are on 15 pages concisely introduced. Somewhat more specialized sections follow about valence-bond methods, relativistic approaches, population analysis, and the calculation of molecular properties. Subsequently, an entire discusses the accuracies of the previous introduced methods, with respect to the calculation of energies, geometries, vibrational frequencies, dipole moments, and so on. Fortunately, this discussion is not limited to the ubiquitous water molecule, but rather treats several systems that are more difficult. In the last third of this work, further points important to the subject of the book are worked through, unfortunately rather disjointedly. The relationships between thermodynamic quantities or absolute rate constants and the calculation of molecular quantities are established. The relevant methods for the optimization of minima and saddle points on potential energy surfaces are discussed and the qualitative concepts of frontier orbital theory and related approaches are expounded. Finally, simulation techniques such as the Monte-Carlo method or molecular dynamics, as well as approximate methods for the inclusion of solvent effect (COSMO, PCM, etc.) are introduced.

Based on the organization of the content and the elementary level of the presentation especially in the first part, this book serves as a useful accompanying text for application-oriented seminars and classes. As a rule, these cover a similar variety of subjects, and do not reduce the modeling and simulation methods to quantum chemistry. Beyond that, the efforts of the author to deliver a modern book that reflects the current state of the art are to be commended. Recent developments, such as hybrid strategies for the combination of force field and quantum-mechanical methods, the R12 approach in the calculations of electron correlation, or fast-multipole as well as pseudospectral methods for the efficient calculation of Columbic interactions are taken up in the discussion. Correspondingly up-to-date are the many useful references, which are as recent as 1998.

Despite this generally positive impression, there are some naturally some details that give rise to critical comments. For example, in some places the mathematical formalisms are described in great detail, while their interpretation is neglected. This is especially striking in the discussion of the density functionals. The highly complex expressions for, for example, Vosko, Wilk, and Nusair (VWN) or Lee, Yang, and Parr (LYP) correlation functionals are reproduced in all their beauty, although the actually do not reflect the underlying physics, but rather springs from purely pragmatic considerations. This reference fails, however, so that the complicated mathematics puts one off and do not impart any increased knowledge. Similar observations can be made about both the overly demanding sections about relativistic methods and the calculation of molecular properties. Here, the level is anything but elementary, much is assumed, and the description is far too compact. It is debatable, for instance, whether the highly complex discussion of propargators methods would be at all helpful to the reader of this book. Similarly, one can ask what the use the reader can make of the barely two-page appendix on the subject of ?second quantization.? which has no recognizable connection to the rest of the text. Here, less would surely have been more. Many smaller inconsistencies also blur the picture, such as when important concepts are used without comment many pages before they are introduced (e.g. ?natural orbitals?), or are never explained in greater detail (e.g. ?gradient norm?). Many misprints have also unfortunately crept in. Apart from the omission of a factor of ?N? in the definition of electron density, these are luckily only distracting and do not invalidate the contents. In the reference section in particular, one finds many wayward spellings of the authors? names. Also conspicuous is the clear and not always professionally understandable preference for Scandinavian authors in the selection of literature references.

Nevertheless, these critical comments should not obscure the fact that this book is an interesting new release. It covers the subject relevant to this area, is modern, and is over all pleasantly and understandably written. Jensen?s book will, despite the small problems, live up to the claims of being a useful introduction to the techniques of computational chemistry. It can be recommended to students of general chemistry,a s well as those scientists interested in the subject, especially in the view of its pleasantly moderate price.

Wolfram Koch
Gesellshaft Deutscher Chemiker
Frankfurt a.M. (Germany)

You can not expect that much from this book.......2002-09-21

Well, this book is a must-read for those who perform ab initio calculations. If you have enough quantum chemistry background, then this book is a good reference for your electronic structure calculations. However, you can not expect that you can learn HF, MPn, CC, CASSCF, CI, SE, etc., from this book. I think the reason for this book being so popular is because there is lack another one of the same introductory level. This book is not simple enough for a beginner as well as not deep enough for advanced readers. It does not discuss all the topic covered in the book in detail (maybe the capter of basis set is the only exception). This book is also lack of a chaper for calculating thermodynamic properties based on ab initio results. Anyway, this book may fill some gaps of my knowledge on ab initio calculations, but I do not enjoy reading it because it never helps to understand the principle of ab initio. For those who want to learn quantum chemistry/ab initio calc., this is absolutely NOT the one. Levine's quantum chemistry (5th) and modern quantum chemisty are the books written in much better style. For MM, TST/statistical mechanics chapters, which should be removed and leave more space for ab initio, I agree with other reviewers.

Worthwhile purchase.......2001-11-21

Provides an excellent overview of quantum mechanical computational chemistry methods. Discusses semiempirical, wave mechanics and density functional approaches in great detail. Also goes a good job discussing basis sets, optimization methods etc. Unfortunately, much less attention is given to other computational methods such as molecular mechanics. If one desires an overview of the entire compuational chemistry field, I reccommend Molecular Modeling by Leach. If your interests lie primarily in QM methods, this book has a more complete discussion of these methods than Leach's text.

A nice book.......2001-08-30

For a brief, general introduction to Computational Chemistry I prefer Grant & Richards', and for a deeper, detailed description of the whole filed, Leach's. Jensen is mainly oriented towards 'ab initio' methods with a touch of Molecular Mechanics.
This book starts with a short introduction to Molecular Mechanics and Dynamics, and then moves on to 'ab initio' Quantum Chemistry methods, to which it is mainly devoted and where it extends in greater detail. There, it becomes an excellent and deeper introduction to all the methods of Quantum Chemistry, and gets its true value.
Detailed descriptions of the different levels of theory, basis sets, density functional theory, semiempirical methods, relativistic methods, etc... make it an excellent introductory reading. Math coverage is just enough to undertand what is going on and how it will affect the computation, but not enough to help you write or design your own software.
There are lots of examples along the book used to illustrate the points, and an invaluable chapter comparing the different methods, their accuracy and performance and their utility in different calculations. The book carefully avoids tying to specific software packages and keeps examples on a higher level thus maintaining its applicability and generality. This is a good book for those mainly interested in Quantum Methods, wishing to learn about them, how they work and how they are applied in practice, as well as how they are implemented and what this will cost in computability and computer time. The initial chapters on MM and MD are detailed enough to provide a starting link to the methods used for more complex molecular systems.

Introduction to Computational Chemistry.......2000-06-12

This informative textbook from Jensen provides a comprehensive review of methods in computational chemistry. The equations are kept to a minimal level to ensure a focus on methodology, as opposed to pure math. This text would suit any higher level undergraduate theoretical course.

Handbook of Statistics 18: Bioenvironmental and Public Health Statistics (Techniques and Instrumentation in Analytical Chemistry)

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Handbook of Statistics 18: Bioenvironmental and Public Health Statistics (Techniques and Instrumentation in Analytical Chemistry)
Pranab Kumar Sen
Manufacturer: Elsevier Publishing Company
ProductGroup: Book
Binding: Hardcover

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ASIN: 0444829008

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Hardbound. In this volume of the Handbook of Statistics with the primary focus on bioenvironmental and public health statistics, a rather off-beat approach has been taken, wherein biostatistical methods that are relevant to the dissemination of bioenvironmental and public health investigations have been thoroughly emphasised, and placed side by side with the fruitful applications. One aspect of statistical methodology that merits special appraisal is the extent of appropriateness of some standard statistical tools in such non-standard applications, and much of the deliberation in this volume is geared to alternative non-standard and application oriented methodology that have been developed to suit better bioenvironmental and public health studies.

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