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  • Springer Handbook of Chem- and Bioinformatics

    Series series Reference Module Chemistry, Materials and Physics
    The Springer Handbook of Chem- and Bioinformatics provides an introduction as well as a detailed description of the application of various techniques used in chemo- and bioinformatics. It covers basic topics such as a discussion of computational techniques used in the predictions of structures, properties, and dynamics of small compounds, macromolecules, and their complexes. Diverse applications ... Read more

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  • Understanding the Basics of QSAR for Applications in Pharmaceutical Sciences and Risk Assessment

    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 ... Read more

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  • A Primer on QSAR/QSPR Modeling

    Fundamental Concepts

    Series series Chemistry and Material Science (R0)
    This brief goes back to basics and describes the Quantitative structure-activity/property relationships (QSARs/QSPRs) that represent predictive models derived from the application of statistical tools correlating biological activity (including therapeutic and toxic) and properties of chemicals (drugs/toxicants/environmental pollutants) with descriptors representative of molecular structure and/or ... Read more

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  • Current Trends in Computational Modeling for Drug Discovery

    Series series Chemistry and Material Science (R0)
    This contributed volume offers a comprehensive discussion on how to design and discover pharmaceuticals using computational modeling techniques. The different chapters deal with the classical and most advanced techniques, theories, protocols, databases, and tools employed in computer-aided drug design (CADD) covering diverse therapeutic classes. Multiple components of Structure-Based Drug ... Read more

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  • Development of Solar Cells

    Theory and Experiment

    Series series Chemistry and Material Science (R0)
    This book presents a comprehensive overview of the fundamental concept, design, working protocols, and diverse photo-chemicals aspects of different solar cell systems with promising prospects, using computational and experimental techniques. It presents and demonstrates the art of designing and developing various solar cell systems through practical examples. Compared to most existing books in the ... Read more

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    Edited by Javier García-Martínez ...
    With the daunting energy challenges faced by Mankind in the 21st century, revolutionary new technologies will be the key to a clean, secure and sustainable energy future. Nanostructures often have surprising and very useful capabilities and are thus paving the way for new methodologies in almost every kind of industry.This exceptional monograph provides an overview of the subject, and presents the ... Read more

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  • Molecular Docking for Computer-Aided Drug Design

    Fundamentals, Techniques, Resources and Applications

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    Molecular Docking for Computer-Aided Drug Design: Fundamentals, Techniques, Resources and Applications offers in-depth coverage on the use of molecular docking for drug design. The book is divided into three main sections that cover basic techniques, tools, web servers and applications. It is an essential reference for students and researchers involved in drug design and discovery. - Covers the ... Read more

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    This unique and comprehensive book covers all the recent physical, chemical, and mechanical advancements in encapsulation nanotechnologies.Encapsulation is prevalent in the evolutionary processes of nature, where nature protects the materials from the environment by engulfing them in a suitable shell. These natural processes are well known and have been adopted and applied in the pharmaceutical, ... Read more

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  • Physiologically Based Pharmacokinetic (PBPK) Modeling and Simulations

    Principles, Methods, and Applications in the Pharmaceutical Industry

    Physiologically Based Pharmacokinetic (PBPK) Modeling and SimulationsThe first book dedicated to the emerging field of physiologically based pharmacokinetic modeling (PBPK)Now in its second edition, Physiologically Based Pharmacokinetic (PBPK) Modelling and Simulations: Principles, Methods, and Applications in the Pharma Industry remains the premier reference book throughout the rapidly growing ... Read more

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