Quantitative Structure Activity Relationships Of Drugs PDF Download
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| Author | : Roy, Kunal |
| Publisher | : IGI Global |
| Total Pages | : 727 |
| Release | : 2015-02-28 |
| Genre | : Technology & Engineering |
| ISBN | : 1466681373 |
Download Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment Book in PDF, ePub and Kindle
Quantitative structure-activity relationships (QSARs) represent predictive models derived from the application of statistical tools correlating biological activity or other properties of chemicals with descriptors representative of molecular structure and/or property. Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment discusses recent advancements in the field of QSARs with special reference to their application in drug development, predictive toxicology, and chemical risk analysis. Focusing on emerging research in the field, this book is an ideal reference source for industry professionals, students, and academicians in the fields of medicinal chemistry and toxicology.
| Author | : John Topliss |
| Publisher | : Elsevier |
| Total Pages | : 535 |
| Release | : 2012-12-02 |
| Genre | : Medical |
| ISBN | : 0323146872 |
Download Quantitative Structure-Activity Relationships of Drugs Book in PDF, ePub and Kindle
Medicinal Chemistry, Volume 19: Quantitative Structure-Activity Relationships of Drugs is a critical review of the applications of various quantitative structure-activity relationship (QSAR) methodologies in different drug therapeutic areas and discusses the results in terms of their contribution to medicinal chemistry. After briefly describing the developments in QSAR research, this 12-chapter volume goes on discussing the contributions of QSAR methodology in elucidating drug action and rational development of drugs against bacterial, fungal, viral, and other parasitic infections of man. Other chapters explore the mode of action and QSAR of antitumor, cardiovascular, antiallergic, antiulcer, antiarthritic, and nonsteroidal antiinflammatory drugs (NSAID) agents. The discussion then shifts to the pharmacologic effects and QSAR analysis of central nervous system agents, steroids, and other hormones. A chapter examines the major chemicals affecting insects and mites, with particular emphasis on the parameters of binding correlation and reactivity for insect and mite enzymes. The concluding chapters cover the limitations of the QSAR approach in the quantitative treatment of drug absorption, distribution, and metabolism. This volume is of great value to medicinal chemists, scientists, and researchers.
| Author | : Kunal Roy |
| Publisher | : Academic Press |
| Total Pages | : 494 |
| Release | : 2015-03-03 |
| Genre | : Medical |
| ISBN | : 0128016337 |
Download Understanding the Basics of QSAR for Applications in Pharmaceutical Sciences and Risk Assessment Book in PDF, ePub and Kindle
Understanding the Basics of QSAR for Applications in Pharmaceutical Sciences and Risk Assessment describes the historical evolution of quantitative structure-activity relationship (QSAR) approaches and their fundamental principles. This book includes clear, introductory coverage of the statistical methods applied in QSAR and new QSAR techniques, such as HQSAR and G-QSAR. Containing real-world examples that illustrate important methodologies, this book identifies QSAR as a valuable tool for many different applications, including drug discovery, predictive toxicology and risk assessment. Written in a straightforward and engaging manner, this is the ideal resource for all those looking for general and practical knowledge of QSAR methods. Includes numerous practical examples related to QSAR methods and applications Follows the Organization for Economic Co-operation and Development principles for QSAR model development Discusses related techniques such as structure-based design and the combination of structure- and ligand-based design tools
| Author | : H. Timmerman |
| Publisher | : Elsevier |
| Total Pages | : 509 |
| Release | : 1995-11-20 |
| Genre | : Computers |
| ISBN | : 0080545009 |
Download QSAR and Drug Design: New Developments and Applications Book in PDF, ePub and Kindle
Based on topics presented at the Annual Japanese (Quantitative) Structure-Activity Relationship Symposium and the Biennial China-Japan Drug Design and Development conference, the topics in this volume cover almost every procedure and subdiscipline in the SAR discipline. They are categorized in three sections. Section one includes topics illustrating newer methodologies relating to ligand-receptor, molecular graphics and receptor modelling as well as the three-dimensional (Q)SAR examples with the active analogue approach and the comparative molecular field analysis. In section 2 the hydrophobicity parameters, log P (1-octanol/water) for compound series of medicinal-chemical interest are analysed physico-organic chemically. Section 3 contains the examples based on the traditional Hansch QSAR approach. A variety of methodologies and procedures are presented in this single volume, along with their methodological philosophies.
| Author | : Hugo Kubinyi |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 413 |
| Release | : 2006-04-11 |
| Genre | : Science |
| ISBN | : 0306468573 |
Download 3D QSAR in Drug Design Book in PDF, ePub and Kindle
Significant progress has been made in the study of three-dimensional quantitative structure-activity relationships (3D QSAR) since the first publication by Richard Cramer in 1988 and the first volume in the series. 3D QSAR in Drug Design. Theory, Methods and Applications, published in 1993. The aim of that early book was to contribute to the understanding and the further application of CoMFA and related approaches and to facilitate the appropriate use of these methods. Since then, hundreds of papers have appeared using the quickly developing techniques of both 3D QSAR and computational sciences to study a broad variety of biological problems. Again the editor(s) felt that the time had come to solicit reviews on published and new viewpoints to document the state of the art of 3D QSAR in its broadest definition and to provide visions of where new techniques will emerge or new appli- tions may be found. The intention is not only to highlight new ideas but also to show the shortcomings, inaccuracies, and abuses of the methods. We hope this book will enable others to separate trivial from visionary approaches and me-too methodology from in- vative techniques. These concerns guided our choice of contributors. To our delight, our call for papers elicited a great many manuscripts.
| Author | : Yvonne C. Martin |
| Publisher | : CRC Press |
| Total Pages | : 292 |
| Release | : 2010-05-06 |
| Genre | : Medical |
| ISBN | : 1420071009 |
Download Quantitative Drug Design Book in PDF, ePub and Kindle
Since the publication of the first edition, the field has changed dramatically. Scientists can now explicitly consider 3D features in quantitative structure-activity relationship (QSAR) studies and often have the 3D structure of the macromolecular target to guide the 3D QSAR. Improvements in computer hardware and software have also made the methods
| Author | : Eric J. Lien |
| Publisher | : CRC Press |
| Total Pages | : 386 |
| Release | : 2020-09-11 |
| Genre | : Medical |
| ISBN | : 1000146898 |
Download SAR Book in PDF, ePub and Kindle
This book focuses on the quantitative structure-activity relationship of the disposition and activities of various pharmacological groups. It presents a systematic approach for linking different side effect of drugs to their molecular structure and physiochemical properties.
| Author | : Hugo Kubinyi |
| Publisher | : John Wiley & Sons |
| Total Pages | : 252 |
| Release | : 2008-07-11 |
| Genre | : Science |
| ISBN | : 3527616837 |
Download QSAR Book in PDF, ePub and Kindle
Finding the new remedy for a certain disease: an inspired goal. QSAR, an invaluable tool in drug design, aids scientists to attain this aim. This book is a long-awaited comprehensive text to QSAR and related approaches. It provides a practice-oriented introduction to the theory, methods and analyses for QSAR relationships, including modelling-based and 3D approaches. Hugo Kubinyi is a leading expert in QSAR. Readers will benefit from the author's 20 years of practical experience, from his careful calculations and recalculations of thousands of QSAR equations. Among the topics covered are: - physiocochemical parameters - quantitative models - statistical methods - Hansch analysis - Free Wilson analysis - 3D-QSAR approaches The book can readily be used as a textbook due to its high didactic value and numerous examples (over 200 equations and 1100 references).
| Author | : Fabio Roli |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 397 |
| Release | : 2004-06 |
| Genre | : Computers |
| ISBN | : 3540221441 |
Download Multiple Classifier Systems Book in PDF, ePub and Kindle
This book constitutes the refereed proceedings of the 5th International Workshop on Multiple Classifier Systems, MCS 2004, held in Cagliari, Italy in June 2004. The 35 revised full papers presented together with 2 invited papers were carefully reviewed and selected from 50 submissions. The papers are organized in topical sections on bagging and boosting, combination methods, design methods, performance analysis, and applications.
| Author | : M Michael Gromiha |
| Publisher | : World Scientific |
| Total Pages | : 424 |
| Release | : 2020-03-05 |
| Genre | : Science |
| ISBN | : 9811211884 |
Download Protein Interactions: Computational Methods, Analysis And Applications Book in PDF, ePub and Kindle
This book is indexed in Chemical Abstracts ServiceThe interactions of proteins with other molecules are important in many cellular activities. Investigations have been carried out to understand the recognition mechanism, identify the binding sites, analyze the the binding affinity of complexes, and study the influence of mutations on diseases. Protein interactions are also crucial in structure-based drug design.This book covers computational analysis of protein-protein, protein-nucleic acid and protein-ligand interactions and their applications. It provides up-to-date information and the latest developments from experts in the field, using illustrations to explain the key concepts and applications. This volume can serve as a single source on comparative studies of proteins interacting with proteins/DNAs/RNAs/carbohydrates and small molecules.
