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In Silico Drug Discovery and Design: Theory, Methods, Challenges, and Applications, Claudio N. Cavasotto


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Автор: Claudio N. Cavasotto
Название:  In Silico Drug Discovery and Design: Theory, Methods, Challenges, and Applications
ISBN: 9781138747586
Издательство: Taylor&Francis
Классификация:





ISBN-10: 1138747580
Обложка/Формат: Paperback
Страницы: 558
Вес: 0.77 кг.
Дата издания: 27.07.2017
Язык: English
Иллюстрации: 25 tables, black and white; 26 illustrations, color; 71 illustrations, black and white
Размер: 235 x 156
Читательская аудитория: Tertiary education (us: college)
Ключевые слова: Pharmaceutical technology, MEDICAL / Pharmacology,MEDICAL / Pharmacy
Подзаголовок: Theory, methods, challenges, and applications
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Поставляется из: Европейский союз
Описание: This text provides an overview of the current methodological strategies in computer-aided drug discovery and design.

In Silico Models for Drug Discovery

Автор: Sandhya Kortagere
Название: In Silico Models for Drug Discovery
ISBN: 1493962973 ISBN-13(EAN): 9781493962976
Издательство: Springer
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Цена: 111790.00 T
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Описание: This Methods in Molecular Biology (TM) book surveys in silico models, offering techniques to derive novel antimicrobial targets and methods for computing binding energies of drugs to their target proteins, plus protocols, materials lists, known pitfalls and more.

In Silico Methods for Predicting Drug Toxicity

Автор: Benfenati
Название: In Silico Methods for Predicting Drug Toxicity
ISBN: 1493936077 ISBN-13(EAN): 9781493936076
Издательство: Springer
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Цена: 167700.00 T
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Описание: This detailed volume explores in silico methods forpharmaceutical toxicity by combiningthe theoretical advanced research with the practical application of the tools.Beginning with a section covering sophisticated models addressing the bindingto receptors, pharmacokinetics and adsorption, metabolism, distribution, andexcretion, the book continues with chapters delving into models for specifictoxicological and ecotoxicological endpoints, as well as broad views of themain initiatives and new perspectives which will very likely improve our way ofmodelling pharmaceuticals. Written for the highly successful Methods in Molecular Biology series,chapters include the kind of detailed implementation advice that is key forachieving successful research results.Authoritative and practical, In Silico Methods for Predicting DrugToxicity offers the advantage of incorporating data and knowledge fromdifferent fields, such as chemistry, biology, -omics, and pharmacology, toachieve goals in this vital area of research.

In Silico Models for Drug Discovery

Автор: Sandhya Kortagere
Название: In Silico Models for Drug Discovery
ISBN: 1627033416 ISBN-13(EAN): 9781627033411
Издательство: Springer
Рейтинг:
Цена: 102480.00 T
Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: This Methods in Molecular Biology (TM) book surveys in silico models, offering techniques to derive novel antimicrobial targets and methods for computing binding energies of drugs to their target proteins, plus protocols, materials lists, known pitfalls and more.

In Silico Methods for Predicting Drug Toxicity

Автор: Emilio Benfenati
Название: In Silico Methods for Predicting Drug Toxicity
ISBN: 1493980939 ISBN-13(EAN): 9781493980932
Издательство: Springer
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Цена: 102480.00 T
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Описание:

1. QSAR Methods

Giuseppina Gini

Part I: Modeling a Pharmaceutical in the Human Body

2. In Silico 3D-Modelling of Binding Activities

Stefano Moro, Mattia Sturlese, Antonella Ciancetta, and Matteo Floris

3. Modeling Pharmacokinetics

Frederic Y. Bois and Cйline Brochot

4. Modeling ADMET

Jayeeta Ghosh, Michael S. Lawless, Marvin Waldman, Vijay Gombar, and Robert Fraczkiewicz

Part II: The Applications of In Silico Models for the Different Endpoints

5. In Silico Prediction of Chemically-Induced Mutagenicity: How to Use QSAR Models and Interpret Their Results

Enrico Mombelli, Giuseppa Raitano, and Emilio Benfenati

6. In Silico Methods for Carcinogenicity Assessment

Azadi Golbamaki and Emilio Benfenati

7. VirtualToxLab: Exploring the Toxic Potential of Rejuvenating Substances Found in Traditional Medicines

Martin Smiesko and Angelo Vedani

8. In Silico Model for Developmental Toxicity: How to Use QSAR Models and Interpret Their Results

Marco Marzo, Alessandra Roncaglioni, Sunil Kulkarni, Tara S. Barton-Maclaren, and Emilio Benfenati

9. In Silico Models for Repeated Dose Toxicity (RDT): Prediction of the No Observed Adverse Effect Level (NOAEL) and Lowest Observed Adverse Effect Level (LOAEL) for Drugs

Fabiola Pizzo and Emilio Benfenati

10. In Silico Models for Acute Systemic Toxicity

Julien Burton, Andrew P. Worth, Ivanka Tsakovska, and Antonia Diukendjieva

11. In Silico Models for Hepatotoxicity

Mark Hewitt and Katarzyna Przybylak

12. In Silico Models for Ecotoxicity of Pharmaceuticals

Kunal Roy and Supratik Kar

13. Use of Read-Across Tools

Serena Manganelli and Emilio Benfenati

Part III: The Scientific and Society Challenges

14. Adverse Outcome Pathways as Tools to Assess Drug-Induced Toxicity

Mathieu Vinken

15. A Systems Biology Approach for Identifying Hepatotoxicant Groups Based on Similarity in Mechanisms of Action and Chemical Structure

Dennie G.A.J. Hebels, Axel Rasche, Ralf Herwig, Gerard J.P. van Westen, Danyel G.J. Jennen, and Jos C.S. Kleinjans

16. In Silico Study of In Vitro GPCR Assays by QSAR Modeling

Kamel Mansouri and Richard S. Judson

17. Taking Advantage of Databases

&n

In Silico Drug Discovery & Design,

Название: In Silico Drug Discovery & Design,
ISBN: 148221783X ISBN-13(EAN): 9781482217834
Издательство: Taylor&Francis
Рейтинг:
Цена: 193950.00 T
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Описание: This text provides an overview of the current methodological strategies in computer-aided drug discovery and design.

In Silico Drug Design

Автор: Roy, Kunal
Название: In Silico Drug Design
ISBN: 0128161256 ISBN-13(EAN): 9780128161258
Издательство: Elsevier Science
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Цена: 153830.00 T
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Описание:

In Silico Drug Design: Repurposing Techniques and Methodologies explores the application of computational tools that can be utilized for this approach. The book covers theoretical background and methodologies of chem-bioinformatic techniques and network modeling and discusses the various applied strategies to systematically retrieve, integrate and analyze datasets from diverse sources. Other topics include in silico drug design methods, computational workflows for drug repurposing, and network-based in silico screening for drug efficacy. With contributions from experts in the field and the inclusion of practical case studies, this book gives scientists, researchers and R&D professionals in the pharmaceutical industry valuable insights into drug design.

  • Discusses the theoretical background and methodologies of useful techniques of cheminformatics and bioinformatics that can be applied for drug repurposing
  • Offers case studies relating to the in silico modeling of FDA-approved drugs for the discovery of antifungal, anticancer, antiplatelet agents, and for drug therapies against diseases
  • Covers tools and databases that can be utilized to facilitate in silico methods for drug repurposing

In Silico Engineering of Disulphide Bonds to Produce Stable Cellulase

Автор: Bahram Barati; Iraj Sadegh Amiri
Название: In Silico Engineering of Disulphide Bonds to Produce Stable Cellulase
ISBN: 9812874313 ISBN-13(EAN): 9789812874313
Издательство: Springer
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Цена: 47880.00 T
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Описание: This Brief highlights different approaches used to create stable cellulase and its use in different fields. In order to improve its thermal stability, it can be engineered using a variety of approaches, such as hydrophobic interactions, aromatic interactions, hydrogen bonds, ion pairs and disulfide bridge creation.

Silicon Nitride: Synthesis, Properties & Applications

Автор: Emiliano Jose Hierra, Jesus Anjel Salazar
Название: Silicon Nitride: Synthesis, Properties & Applications
ISBN: 1619428652 ISBN-13(EAN): 9781619428652
Издательство: Nova Science
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Цена: 211190.00 T
Наличие на складе: Невозможна поставка.
Описание: Silicon nitride (Si3N4) ceramic is used in numerous applications because of its superior properties, such as high-temperature strength, good oxidation resistance and low thermal expansion coefficient. In this book, the authors present current research in the study of the synthesis, properties and applications of silicon nitride. Topics include the optical and vibration properties of silicon rich nitride; high temperature oxidation of silicon nitride based ceramics; low temperature preparation of phosphate bonded silicon nitride ceramics with high mechanical strength; the SPS-sintering process and use of ceramics for high-temperature engineering applications; synthesis and properties of silicon nitride coatings; and the use of silicon nitride as biomaterial.

Porous Silicon Multilayers: Synthesis & Applications

Автор: Mosbah Amlouk
Название: Porous Silicon Multilayers: Synthesis & Applications
ISBN: 162100578X ISBN-13(EAN): 9781621005780
Издательство: Nova Science
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Цена: 65460.00 T
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Описание: During World War II, Academy Award-winning director Frank Capra made propaganda films for the U.S. Government, such as Prelude to War, The Nazis Strike, The Battle of Britain, War Comes to America and The Negro Soldier. This analyses the cinematic and thematic techniques Capra employed in these films, linking them to the techniques and ideology of the director`s popular mainstream narrative films.

Silicon Carbide Biotechnology: A Biocompatible Semiconductor for Advanced Biomedical Devices and Applications

Автор: Saddow Stephen
Название: Silicon Carbide Biotechnology: A Biocompatible Semiconductor for Advanced Biomedical Devices and Applications
ISBN: 012810354X ISBN-13(EAN): 9780128103548
Издательство: Elsevier Science
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Цена: 152290.00 T
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Описание: Silicon Carbide (SiC) is a wide-band-gap semiconductor biocompatible material that has the potential to advance advanced biomedical applications. SiC devices offer higher power densities and lower energy losses, enabling lighter, more compact and higher efficiency products for biocompatible and long-term in vivo applications ranging from heart stent coatings and bone implant scaffolds to neurological implants and sensors. The main problem facing the medical community today is the lack of biocompatible materials that are also capable of electronic operation. Such devices are currently implemented using silicon technology, which either has to be hermetically sealed so it cannot interact with the body or the material is only stable in vivo for short periods of time. . For long term use (permanent implanted devices such as glucose sensors, brain-machine-interface devices, smart bone and organ implants) a more robust material that the body does not recognize and reject as a foreign (i.e., not organic) material is needed. Silicon Carbide has been proven to be just such a material and will open up a whole new host of fields by allowing the development of advanced biomedical devices never before possible for long-term use in vivo. . . This book not only provides the materials and biomedical engineering communities with a seminal reference book on SiC that they can use to further develop the technology, it also provides a technology resource for medical doctors and practitioners who are hungry to identify and implement advanced engineering solutions to their everyday medical problems that currently lack long term, cost effective solutions.

Biophysical Methods for Biotherapeutics - Discovery and Development Applications

Автор: Das
Название: Biophysical Methods for Biotherapeutics - Discovery and Development Applications
ISBN: 0470938439 ISBN-13(EAN): 9780470938430
Издательство: Wiley
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Цена: 118220.00 T
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Описание: With a focus on practical applications of biophysical techniques, Biophysical Methods for Biotherapeutics helps formulation and analytical scientists in pharma and biotech better understand and use biophysical methods. Author Tapan K.

Ocular Drug Delivery: Advances, Challenges and Applications

Автор: Richard T. Addo
Название: Ocular Drug Delivery: Advances, Challenges and Applications
ISBN: 3319476890 ISBN-13(EAN): 9783319476896
Издательство: Springer
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Цена: 139750.00 T
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Описание: The eye is a computerized system that has been designed for self-defense, and these defense mechanisms create challenges in administration of medications to the eye. Therefore, ocular drug delivery has been a major challenge to drug delivery researchers. There are on-going studies, in search of treatment especially for the diseases affecting the posterior segment of the eye. This book gives and overview of the background of ocular drug delivery and is unique for pharmacists, medical practitioners, students and drug delivery researchers.


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