Computational Inorganic and Bioinorganic Chemistry

Computational Inorganic and Bioinorganic Chemistry

Part 1 of this volume focuses on methods, their background and implementation, and their use in describing bonding properties, energies, transition states and spectroscopic features.

Author: Edward I. Solomon

Publisher: John Wiley & Sons

ISBN: 9781118617236

Category: Science

Page: 616

View: 437

Over the past several decades there have been major advances in our ability to computationally evaluate the electronic structure of inorganic molecules, particularly transition metal systems. This advancement is due to the Moore’s Law increase in computing power as well as the impact of density functional theory (DFT) and its implementation in commercial and freeware programs for quantum chemical calculations. Improved pure and hybrid density functionals are allowing DFT calculations with accuracy comparable to high-level Hartree-Fock treatments, and the results of these calculations can now be evaluated by experiment. When calculations are correlated to, and supported by, experimental data they can provide fundamental insight into electronic structure and its contributions to physical properties and chemical reactivity. This interplay continues to expand and contributes to both improved value of experimental results and improved accuracy of computational predictions. The purpose of this EIC Book is to provide state-of-the-art presentations of quantum mechanical and related methods and their applications, written by many of the leaders in the field. Part 1 of this volume focuses on methods, their background and implementation, and their use in describing bonding properties, energies, transition states and spectroscopic features. Part 2 focuses on applications in bioinorganic chemistry and Part 3 discusses inorganic chemistry, where electronic structure calculations have already had a major impact. This addition to the EIC Book series is of significant value to both experimentalists and theoreticians, and we anticipate that it will stimulate both further development of the methodology and its applications in the many interdisciplinary fields that comprise modern inorganic and bioinorganic chemistry. This volume is also available as part of Encyclopedia of Inorganic Chemistry, 5 Volume Set. This set combines all volumes published as EIC Books from 2007 to 2010, representing areas of key developments in the field of inorganic chemistry published in the Encyclopedia of Inorganic Chemistry. Find out more.
Categories: Science

Bioinorganic Chemistry

Bioinorganic Chemistry

The Coverage In This Book Is Organised In Terms Of The Syllabus Prescribed In Ugc Model Curriculum 2001 For Both Undergraduate And Postgraduate Students Of Chemistry And Biological Sciences.The Book Provides A Comprehensive And In-Depth ...

Author: K. Hussain Reddy

Publisher: New Age International

ISBN: 8122414370

Category: Biomineralization

Page: 368

View: 307

The Coverage In This Book Is Organised In Terms Of The Syllabus Prescribed In Ugc Model Curriculum 2001 For Both Undergraduate And Postgraduate Students Of Chemistry And Biological Sciences.The Book Provides A Comprehensive And In-Depth Treatment Of The Subject. In Addition To Explaining The Basic Principles And Applications In Bioinorganic Chemistry, The Book Also Describes: * Photosynthesis. * Metal Complexes And Their Interaction With Nucleic Acids. * Effect Of Inorganic Pollutants On Biological Systems.The Book Would Serve As An Ideal Text For Students Of Chemistry And Biological Sciences. Researchers In Related Areas Would Find It An Extremely Useful Reference Source.
Categories: Biomineralization

Bioinorganic Chemistry

Bioinorganic Chemistry

Introduces students to the basics of bioinorganic chemistry This book provides the fundamentals for inorganic chemistry and biochemistry relevant to understanding bioinorganic topics.

Author: Rosette M. Roat-Malone

Publisher: John Wiley & Sons

ISBN: 9781119535218

Category: Science

Page: 352

View: 239

Introduces students to the basics of bioinorganic chemistry This book provides the fundamentals for inorganic chemistry and biochemistry relevant to understanding bioinorganic topics. It provides essential background material, followed by detailed information on selected topics, to give readers the background, tools, and skills they need to research and study bioinorganic topics of interest to them. To reflect current practices and needs, instrumental methods and techniques are referred to and mixed in throughout the book. Bioinorganic Chemistry: A Short Course, Third Edition begins with a chapter on Inorganic Chemistry and Biochemistry Essentials. It then continues with chapters on: Computer Hardware, Software, and Computational Chemistry Methods; Important Metal Centers in Proteins; Myoglobins, Hemoglobins, Superoxide Dismutases, Nitrogenases, Hydrogenases, Carbonic Anhydrases, and Nitrogen Cycle Enzymes. The book concludes with chapters on Nanobioinorganic Chemistry and Metals in Medicine. Readers are also offered end-of-section summaries, conclusions, and thought problems. Reduces size of the text from previous edition to match the first, keeping it appropriate for a one-semester course Offers primers and background materials to help students feel comfortable with research-level bioinorganic chemistry Emphasizes select and diverse topics using extensive references from current scientific literature, with more emphasis on molecular biology in the biochemistry section, leading to a discussion of CRISPR technology Adds new chapters on hydrogenases, carbonic anhydrases, and nitrogen cycle enzymes, along with a separate chapter on nanobioinorganic chemistry Features expanded coverage of computer hardware and software, metalloenzymes, and metals in medicines Supplemented with a companion website for students and instructors featuring Powerpoint and JPEG figures and tables, arranged by chapter Appropriate for one-semester bioinorganic chemistry courses, Bioinorganic Chemistry: A Short Course, Third Edition is ideal for upper-level undergraduate and beginning graduate students. It is also a valuable reference for practitioners and researchers in need of a general introduction to the subject, as well as chemists requiring an accessible reference.
Categories: Science

Biological Inorganic Chemistry

Biological Inorganic Chemistry

Part A.: Overviews of biological inorganic chemistry : 1.

Author: Gray Bertini

Publisher: University Science Books

ISBN: 1891389432

Category: Science

Page: 739

View: 742

Part A.: Overviews of biological inorganic chemistry : 1. Bioinorganic chemistry and the biogeochemical cycles -- 2. Metal ions and proteins: binding, stability, and folding -- 3. Special cofactors and metal clusters -- 4. Transport and storage of metal ions in biology -- 5. Biominerals and biomineralization -- 6. Metals in medicine. -- Part B.: Metal ion containing biological systems : 1. Metal ion transport and storage -- 2. Hydrolytic chemistry -- 3. Electron transfer, respiration, and photosynthesis -- 4. Oxygen metabolism -- 5. Hydrogen, carbon, and sulfur metabolism -- 6. Metalloenzymes with radical intermediates -- 7. Metal ion receptors and signaling. -- Cell biology, biochemistry, and evolution: Tutorial I. -- Fundamentals of coordination chemistry: Tutorial II.
Categories: Science

Bioinorganic Chemistry Inorganic Elements in the Chemistry of Life

Bioinorganic Chemistry    Inorganic Elements in the Chemistry of Life

The second edition of this classic text has been fully revised and updated to include new structure information, emerging developments in the field, and an increased focus on medical applications of inorganic compounds.

Author: Wolfgang Kaim

Publisher: John Wiley & Sons

ISBN: 9781118659267

Category: Science

Page: 456

View: 453

The field of Bioinorganic Chemistry has grown significantly inrecent years; now one of the major sub-disciplines of InorganicChemistry, it has also pervaded other areas of the life sciencesdue to its highly interdisciplinary nature. Bioinorganic Chemistry: Inorganic Elements in the Chemistryof Life, Second Edition provides a detailed introduction to therole of inorganic elements in biology, taking a systematicelement-by-element approach to the topic. The second edition ofthis classic text has been fully revised and updated to include newstructure information, emerging developments in the field, and anincreased focus on medical applications of inorganic compounds. Newtopics have been added including materials aspects of bioinorganicchemistry, elemental cycles, bioorganometallic chemistry, medicalimaging and therapeutic advances. Topics covered include: Metals at the center of photosynthesis Uptake, transport, and storage of essential elements Catalysis through hemoproteins Biological functions of molybdenum, tungsten, vanadium andchromium Function and transport of alkaline and alkaline earth metalcations Biomineralization Biological functions of the non-metallic inorganicelements Bioinorganic chemistry of toxic metals Biochemical behavior of radionuclides and medical imaging usinginorganic compounds Chemotherapy involving non-essential elements This full color text provides a concise and comprehensive review ofbioinorganic chemistry for advanced students of chemistry,biochemistry, biology, medicine and environmental science.
Categories: Science

Bioinorganic Chemistry

Bioinorganic Chemistry

The emergence of bioinorganic chemistry is related to the general development
of science. Biochemistry has evolved to the point where biological processes can
be understood and explained in terms of molecules and electrons. Inorganic ...

Author: Ei-ichiro Ochiai

Publisher:

ISBN: UOM:39015005800217

Category: Biochemistry

Page: 515

View: 272

Categories: Biochemistry

Bioinorganic Chemistry

Bioinorganic Chemistry

Transition Metals in Biology and Their Coordination Chemistry Alfred X.
Trautwein. Introduction Bernhard Lippert Within the field of bioinorganic
chemistry , ' metals in medicine ' and ' metal - nucleic acid interactions ' represent
well ...

Author: Alfred X. Trautwein

Publisher: Wiley-VCH

ISBN: STANFORD:36105021461749

Category: Science

Page: 767

View: 358

Whenever nature has a difficult task to perform it can be expected that a metal ion or a cluster of such ions is employed. Metal ions are indispensable for the integrity of biological structures and the catalysis of biological reactions. Knowledge about their mode of action, their uptake in the cell, their handling and their storage is important for the development of new pharmaceuticals. This book summarizes latest results of interdisciplinary research on several universities.
Categories: Science

Bioinorganic Chemistry

Bioinorganic Chemistry

Lancaster JR Jr ( ed ) ( 1988 ) The bioinorganic chemistry of nickel . VCH , New
York 28 . Maroney MJ ( 1994 ) Nickel : models of protein active sites . In : King RB
( ed ) Encyclopedia of Inorganic Chemistry . Wiley , Chichester , p 2412 29 .

Author: R. J. Williams

Publisher: Springer Verlag

ISBN: UVA:X004118900

Category: Science

Page: 207

View: 801

In this book the first three chapters outline the chemistry of nickel and heme largely associated with anaerobic life and believed to represent reactions which took place some 3-4x109years ago. Nickel has disappeared from the chemistry of man. The fascinating detail of the "primitive" catalysts is of interest to industrial society since very simple feed-stock is used, hydrogen, carbon monoxide and sulphate for example. The fourth chapter switches attention to a metal which became valuable later in evolution, copper, and which is involved with the use of dioxygen. It also has extremely interesting catalytic sites in enzymes. The essence of the volume lies in an appreciation of metallo- enzymes and their changing roles as the environment changed.
Categories: Science

Mechanistic Bioinorganic Chemistry

Mechanistic Bioinorganic Chemistry

Understanding the Mechanisms in Bioinorganic Chemistry H . Holden Thorp
Department of Chemistry , University of North Carolina , Chapel Hill , NC 27599 -
3290 The field of bioinorganic chemistry has experienced tremendous growth in
 ...

Author: American Chemical Society. Meeting

Publisher: Amer Chemical Society

ISBN: UVA:X002240040

Category: Science

Page: 505

View: 176

Provides an understanding of bioinorganic reactions from a mechanistic point of view. Illustrates how spectroscopy can be used to establish mechanisms and how model compounds provide mechanistic insight for enzymes. Demonstrates how to apply numerous physical methods to understanding mechanisms of redox catalysis by metal centers in enzymes. Highlights the interrelationships between the roles of metal ions in electron transfer, redox catalysis, structural roles, and hydrolytic chemistry. Provides mechanistic insights into water oxidation, nitrogen fixation, nucleic acid oxidation and hydrolysis, oxygen binding, catalase reactions, and electron transfer.
Categories: Science

Frontiers in Bioinorganic Chemistry

Frontiers in Bioinorganic Chemistry

Chem 373 - 0153 chem 5 - 3006 Preface Bioinorganic chemistry , an
interdisciplinary field " par excellence " , has been defined as the science which
brings inorganic chemistry into life , by recognizing the fundamental importance
of life ...

Author: Antonio V. Xavier

Publisher: John Wiley & Sons

ISBN: 3527264604

Category: Bioinorganic chemistry

Page: 736

View: 595

Categories: Bioinorganic chemistry

Bioinorganic Chemistry II

Bioinorganic Chemistry II

Division of Inorganic Chemistry, American Chemical Society. Division of
Biological Chemistry. PREFACE Although the term “ bioinorganic chemistry ” is
relatively new , this area A of research can be traced back at least as far as the
late 1800 ...

Author: Kenneth N. Raymond

Publisher:

ISBN: UOM:39015018146079

Category: Biochemistry

Page: 448

View: 99

Categories: Biochemistry

Concepts and Models in Bioinorganic Chemistry

Concepts and Models in Bioinorganic Chemistry

Destined to set the standard , this book meets the need for a didactic textbook
focusing on the role of model systems in bioinorganic chemistry . The first part
features concepts in bioinorganic chemistry such as electron transfer , medicinal
 ...

Author: Heinz-Bernhard Kraatz

Publisher: Wiley-VCH

ISBN: UOM:39015064750915

Category: Science

Page: 443

View: 884

This didactic textbook provides a brief background on relevant biological systems and describes their structural, functional and spectroscopic results, while summarizing key developments and compounds in the respective model systems.
Categories: Science

Spectroscopic Methods in Bioinorganic Chemistry

Spectroscopic Methods in Bioinorganic Chemistry

It brought together many of the major international researchers in the field of
spectroscopy in bioinorganic chemistry . It was also designed to have a broad -
based appeal to researchers in the fields of bioinorganic , physical - inorganic ...

Author: Edward I. Solomon

Publisher: Amer Chemical Society

ISBN: UOM:39015042167653

Category: Science

Page: 468

View: 298

This volume contains recent advances in spectrographic methods, including EPR, magnetic Mossbauer, paramagnetic and multi-D NMR, metalloprotein crystallography, EAS, magnetic circular dichroism, resonance Raman, X-ray absorption spectroscopy, and electron structure calculations. The book concentrates on topics where spectrographic methods have had a major impact, such as electron transfer, cluster interactions, intermediates, and definition of active site structure, and it includes a thorough tutorial on basic methods.
Categories: Science

The Bioinorganic Chemistry of Nickel

The Bioinorganic Chemistry of Nickel

Albracht , S. P. J .; van der Zwaan , J. W .; Fontijn , R. D .; Slater , E. C. In “
Frontiers in Bioinorganic Chemistry , ” . Xavier , A. V. ( Ed . ) ; VCH
Verlagsgesellschaft : Weinheim , 1986 , pp . 11-19 . 15. Moura , J. J. G .; Teixeira ,
M .; Moura , I .

Author: Jack R. Lancaster

Publisher: Vch Pub

ISBN: UCSD:31822002464261

Category: Science

Page: 337

View: 171

Categories: Science

Bioinorganic Chemistry

Bioinorganic Chemistry

This comprehensive series of volumes on inorganic chemistry provides inorganic chemists with a forum for critical, authoritative evaluations of advances in every area of the discipline.

Author: Stephen J. Lippard

Publisher: John Wiley & Sons

ISBN: 9780470166963

Category: Science

Page: 535

View: 734

This comprehensive series of volumes on inorganic chemistry provides inorganic chemists with a forum for critical, authoritative evaluations of advances in every area of the discipline. Every volume reports recent progress with a significant, up-to-date selection of papers by internationally recognized researchers, complemented by detailed discussions and complete documentation. Each volume features a complete subject index and the series includes a cumulative index as well.
Categories: Science

Bioinorganic Chemistry

Bioinorganic Chemistry

Bioinorganic chemistry is primarily concerned with the role of metal atoms in biology and is a very active research field.

Author: D.P. Kessissoglou

Publisher: Springer Science & Business Media

ISBN: 9789401102551

Category: Science

Page: 415

View: 939

Bioinorganic chemistry is primarily concerned with the role of metal atoms in biology and is a very active research field. However, even though such important structures of metalloenzymes are known, as the MoFeCo of nitrogenase, Cu or Mn superoxide dismutase and plastocyanin, the synthetic routes to the modelling of such centers remains a matter of acute scientific interest. Other metalloenzymes, such as the Mn center of the oxygen evolving complex of PSII, are still the focus of in-depth examination, both spectroscopic and structural. Another area of concern is the interaction between drugs and metals and metal ion antagonism. Understanding the chemistry of metal ions in biological systems will bring benefits in terms of understanding such problems as biomineralization and the production of advanced materials by micro-organisms. The 29 contributions to Bioinorganic Chemistry: An Inorganic Perspective of Life give an excellent summary of the state of the art in this field, covering areas from the NMR of paramagnetic molecules to the use of lanthanide porphyrins in artificial batteries.
Categories: Science

Some Bioinorganic Chemistry of Ribonucleotide Reductase from Escherichia Coli

Some Bioinorganic Chemistry of Ribonucleotide Reductase from Escherichia Coli

Some Bioinorganic Chemistry of Ribonucleotide Reductase from Escherichia coli
: Spectroscopic Investigations of a Nitric Oxide Reaction and Two Mutant Proteins
A THESIS SUBMITTED TO THE FACULTY OF THE GRADUATE SCHOOL OF ...

Author: Charlene Joy Haskin

Publisher:

ISBN: MINN:31951P005031178

Category:

Page: 328

View: 724

Categories:

Bioinorganic Chemistry

Bioinorganic Chemistry

Written by major contributors to the field, Bioinorganic Chemistry provides students with an introduction and overview of the subject and gives them the background required to read and follow the current research literature.

Author: Ivano Bertini

Publisher: Univ Science Books

ISBN: UOM:39015032835889

Category: Medical

Page: 611

View: 557

Written by major contributors to the field, Bioinorganic Chemistry provides students with an introduction and overview of the subject and gives them the background required to read and follow the current research literature.
Categories: Medical

Permuted Medical Subject Headings

Permuted Medical Subject Headings

BIOCHEMICAL PHENOMENA ( NON MESH BIOCHEMICAL PHENOMENA ,
METABOLISM , NUTRITION ( NON MESH BIOCHEMISTRY BIOINORGANIC
CHEMISTRY see CHEMISTRY , BIOINORGANIC BLOOD CHEMICAL ANALYSIS
BRAIN ...

Author: National Library of Medicine (U.S.)

Publisher:

ISBN: UOM:39015020966514

Category: Medicine

Page:

View: 150

Categories: Medicine

Bioinorganic Chemistry

Bioinorganic Chemistry

This book presents a unique introduction into the field of bioinorganic chemistry through practical laboratory experiments.

Author: Nils Metzler-Nolte

Publisher: Walter de Gruyter

ISBN: 9783110211368

Category: Science

Page: 147

View: 959

This book presents a unique introduction into the field of bioinorganic chemistry through practical laboratory experiments. Topics include many aspects of modern bioinorganic chemistry such as model systems for metalloenzymes, biosensors, metal bioconjugates and metal-based drugs. Each chapter contains a brief introduction, followed by detailed experimental procedures, completed with all necessary background information for the student as well as their instructors. A valuable supplement to standard textbooks of inorganic and bioinorganic chemistry Essential for all instructors teaching laboratory courses in general and inorganic chemistry
Categories: Science