Ligand Macromolecular Interactions In Drug Discovery
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Ligand Macromolecular Interactions In Drug Discovery
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Author : Ana Cecília A. Roque
language : en
Publisher: Methods in Molecular Biology
Release Date : 2010-03-23
Ligand Macromolecular Interactions In Drug Discovery written by Ana Cecília A. Roque and has been published by Methods in Molecular Biology this book supported file pdf, txt, epub, kindle and other format this book has been release on 2010-03-23 with Medical categories.
In this authoritative book, experts in the field highlight the main principles and methodologies currently utilized in the study of molecular interactions between compounds. This is as an ideal guide to those striving to further our knowledge of medicines.
Nmr Methods For Elucidating Macromolecule Ligand Interactions
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Author : Robert E. Handschumacher
language : en
Publisher: Pergamon
Release Date : 1990
Nmr Methods For Elucidating Macromolecule Ligand Interactions written by Robert E. Handschumacher and has been published by Pergamon this book supported file pdf, txt, epub, kindle and other format this book has been release on 1990 with Drugs categories.
The 4th Symposium was held in New Haven, Conn., July 1989. The four sessions cover current NMR structural methodology and its application; analysis of bioactive peptide conformation; macromolecular target recognition; and drug-macromolecular interactions. No index. Annotation copyright Book News, In
Computational And Structural Approaches To Drug Discovery
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Author : Robert M. Stroud
language : en
Publisher: Royal Society of Chemistry
Release Date : 2008
Computational And Structural Approaches To Drug Discovery written by Robert M. Stroud and has been published by Royal Society of Chemistry this book supported file pdf, txt, epub, kindle and other format this book has been release on 2008 with Medical categories.
This insightful book represents the experience and understanding of the global experts in the field and spotlights both the structural and medicinal chemistry aspects of drug design. The need to 'encode' the physiological factors of pharmacology, a key area, is explored.
Protein Ligand Interactions
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Author : Hans-Joachim Böhm
language : en
Publisher: John Wiley & Sons
Release Date : 2006-03-06
Protein Ligand Interactions written by Hans-Joachim Böhm and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2006-03-06 with Science categories.
The lock-and-key principle formulated by Emil Fischer as early as the end of the 19th century has still not lost any of its significance for the life sciences. The basic aspects of ligand-protein interaction may be summarized under the term 'molecular recognition' and concern the specificity as well as stability of ligand binding. Molecular recognition is thus a central topic in the development of active substances, since stability and specificity determine whether a substance can be used as a drug. Nowadays, computer-aided prediction and intelligent molecular design make a large contribution to the constant search for, e. g., improved enzyme inhibitors, and new concepts such as that of pharmacophores are being developed. An up-to-date presentation of an eternally young topic, this book is an indispensable information source for chemists, biochemists and pharmacologists dealing with the binding of ligands to proteins.
Protein Ligand Interactions
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Author : Holger Gohlke
language : en
Publisher: John Wiley & Sons
Release Date : 2012-06-04
Protein Ligand Interactions written by Holger Gohlke and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-06-04 with Medical categories.
Innovative and forward-looking, this volume focuses on recent achievements in this rapidly progressing field and looks at future potential for development. The first part provides a basic understanding of the factors governing protein-ligand interactions, followed by a comparison of key experimental methods (calorimetry, surface plasmon resonance, NMR) used in generating interaction data. The second half of the book is devoted to insilico methods of modeling and predicting molecular recognition and binding, ranging from first principles-based to approximate ones. Here, as elsewhere in the book, emphasis is placed on novel approaches and recent improvements to established methods. The final part looks at unresolved challenges, and the strategies to address them. With the content relevant for all drug classes and therapeutic fields, this is an inspiring and often-consulted guide to the complexity of protein-ligand interaction modeling and analysis for both novices and experts.
Nmr Methods For Elucidating Macromolecule Ligand Interactions
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Author :
language : en
Publisher:
Release Date : 1990
Nmr Methods For Elucidating Macromolecule Ligand Interactions written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1990 with categories.
Multifaceted Roles Of Crystallography In Modern Drug Discovery
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Author : Giovanna Scapin
language : en
Publisher: Springer
Release Date : 2015-02-27
Multifaceted Roles Of Crystallography In Modern Drug Discovery written by Giovanna Scapin and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2015-02-27 with Science categories.
The present work offers a snapshot of the state-of-the-art of crystallographic, analytical, and computational methods used in modern drug design and development. Topics discussed include: drug design against complex systems (membrane proteins, cell surface receptors, epigenetic targets, and ribosomes); modulation of protein-protein interactions; the impact of small molecule structures in drug discovery and the application of concepts such as molecular geometry, conformation, and flexibility to drug design; methodologies for understanding and characterizing protein states and protein-ligand interactions during the drug design process; and monoclonal antibody therapies. These methods are illustrated through their application to problems of medical and biological significance, such as viral and bacterial infections, diabetes, autoimmune disease, and CNS diseases. As approaches to drug discovery have changed over time, so have the methodologies used to solve the varied, new, and difficult problems encountered in drug discovery. In recent years we have seen great progress in the fields of genetics, biology, chemistry, and medicine, but there are still many unmet medical needs, from bacterial infections to cancer to chronic maladies, that require novel, different, or better therapies. This work will be of interest to researchers and policy makers interested in the latest developments in drug design.
Protein Ligand Interactions And Drug Design
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Author : Flavio Ballante
language : en
Publisher:
Release Date : 2021
Protein Ligand Interactions And Drug Design written by Flavio Ballante and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2021 with Cheminformatics categories.
This detailed book collects modern and established computer-based methods aimed at addressing the drug discovery challenge from disparate perspectives by exploiting information on ligand-protein recognition. Beginning with methods that allow for the exploration of specific areas of chemical space and the designing of virtual libraries, the volume continues with sections on methods based on docking, quantitative models, and molecular dynamics simulations, which are employed for ligand discovery or development, as well as methods exploiting an ensemble of protein structures for the identification of potential protein targets. Written for the highly successful Methods in Molecular Biology series, chapters include introductions to their respective topics, lists of the necessary materials, step-by-step, readily reproducible laboratory protocols, and tips on troubleshooting and avoiding known pitfalls. Authoritative and cutting-edge, Protein-Ligand Interactions and Drug Design provides detailed practical procedures of solid computer-aided drug design methodologies employed to rationalize and optimize protein-ligand interactions, for experienced researchers and novices alike.
Structure Based Drug Discovery
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Author : Roderick E Hubbard
language : en
Publisher: Royal Society of Chemistry
Release Date : 2007-10-31
Structure Based Drug Discovery written by Roderick E Hubbard and has been published by Royal Society of Chemistry this book supported file pdf, txt, epub, kindle and other format this book has been release on 2007-10-31 with Medical categories.
Structure-based drug discovery is a collection of methods that exploits the ability to determine and analyse the three dimensional structure of biological molecules. These methods have been adopted and enhanced to improve the speed and quality of discovery of new drug candidates. After an introductory overview of the principles and application of structure-based methods in drug discovery, this book then describes the essential features of the various methods. Chapters on X-ray crystallography, NMR spectroscopy, and computational chemistry and molecular modelling describe how these particular techniques have been enhanced to support rational drug discovery, with discussions on developments such as high throughput structure determination, probing protein-ligand interactions by NMR spectroscopy, virtual screening and fragment-based drug discovery. The concluding chapters complement the overview of methods by presenting case histories to demonstrate the major impact that structure-based methods have had on discovering drug molecules. Written by international experts from industry and academia, this comprehensive introduction to the methods and practice of structure-based drug discovery not only illustrates leading-edge science but also provides the scientific background for the non-expert reader. The book provides a balanced appraisal of what structure-based methods can and cannot contribute to drug discovery. It will appeal to industrial and academic researchers in pharmaceutical sciences, medicinal chemistry and chemical biology, as well as providing an insight into the field for recent graduates in the biomolecular sciences.
Computational And Structural Approaches To Drug Discovery
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Author : Robert Stroud
language : en
Publisher:
Release Date : 2007
Computational And Structural Approaches To Drug Discovery written by Robert Stroud and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2007 with categories.