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Molecular modeling techniques have been widely used in drug discovery fields for rational drug design and compound screening. Now these techniques are used to model or mimic the behavior of molecules, and help us study formulation at the molecular level. Computational pharmaceutics enables us to understand the mechanism of drug delivery, and to develop new drug delivery systems. The book discusses the modeling of different drug delivery systems, including cyclodextrins, solid dispersions, polymorphism prediction, dendrimer-based delivery systems, surfactant-based micelle, polymeric drug delivery systems, liposome, protein/peptide formulations, non-viral gene delivery systems, drug-protein binding, silica nanoparticles, carbon nanotube-based drug delivery systems, diamond nanoparticles and layered double hydroxides (LDHs) drug delivery systems. Although there are a number of existing books about rational drug design with molecular modeling techniques, these techniques still look mysterious and daunting for pharmaceutical scientists. This book fills the gap between pharmaceutics and molecular modeling, and presents a systematic and overall introduction to computational pharmaceutics. It covers all introductory, advanced and specialist levels. It provides a totally different perspective to pharmaceutical scientists, and will greatly facilitate the development of pharmaceutics. It also helps computational chemists to look for the important questions in the drug delivery field. This book is included in the Advances in Pharmaceutical Technology book series.
This open access book summarizes the research done and results obtained in the second funding phase of the Priority Program 1648 "Software for Exascale Computing" (SPPEXA) of the German Research Foundation (DFG) presented at the SPPEXA Symposium in Dresden during October 21-23, 2019. In that respect, it both represents a continuation of Vol. 113 in Springer’s series Lecture Notes in Computational Science and Engineering, the corresponding report of SPPEXA’s first funding phase, and provides an overview of SPPEXA’s contributions towards exascale computing in today's sumpercomputer technology. The individual chapters address one or more of the research directions (1) computational algorithms, (2) system software, (3) application software, (4) data management and exploration, (5) programming, and (6) software tools. The book has an interdisciplinary appeal: scholars from computational sub-fields in computer science, mathematics, physics, or engineering will find it of particular interest.
This book includes papers presented at the Second International Conference on Electronic Engineering and Renewable Energy (ICEERE 2020), which focus on the application of artificial intelligence techniques, emerging technology and the Internet of things in electrical and renewable energy systems, including hybrid systems, micro-grids, networking, smart health applications, smart grid, mechatronics and electric vehicles. It particularly focuses on new renewable energy technologies for agricultural and rural areas to promote the development of the Euro-Mediterranean region. Given its scope, the book is of interest to graduate students, researchers and practicing engineers working in the fields of electronic engineering and renewable energy.
Parallel algorithms Made Easy The complexity of today's applications coupled with the widespread use of parallel computing has made the design and analysis of parallel algorithms topics of growing interest. This volume fills a need in the field for an introductory treatment of parallel algorithms-appropriate even at the undergraduate level, where no other textbooks on the subject exist. It features a systematic approach to the latest design techniques, providing analysis and implementation details for each parallel algorithm described in the book. Introduction to Parallel Algorithms covers foundations of parallel computing; parallel algorithms for trees and graphs; parallel algorithms for sorting, searching, and merging; and numerical algorithms. This remarkable book: * Presents basic concepts in clear and simple terms * Incorporates numerous examples to enhance students' understanding * Shows how to develop parallel algorithms for all classical problems in computer science, mathematics, and engineering * Employs extensive illustrations of new design techniques * Discusses parallel algorithms in the context of PRAM model * Includes end-of-chapter exercises and detailed references on parallel computing. This book enables universities to offer parallel algorithm courses at the senior undergraduate level in computer science and engineering. It is also an invaluable text/reference for graduate students, scientists, and engineers in computer science, mathematics, and engineering.
This excellent, innovative reference offers a wealth of useful information and a solid background in the fundamentals of aerodynamics. Fluid mechanics, constant density inviscid flow, singular perturbation problems, viscosity, thin-wing and slender body theories, drag minimalization, and other essentials are addressed in a lively, literate manner and accompanied by diagrams.
The book informs about agricultural landscapes, their features, functions and regulatory mechanisms. It characterizes agricultural production systems, trends of their development, and their impacts on the landscape. Agricultural landscapes are multifunctional systems, coupled with all nexus problems of the 21th century. This has led to serious discrepancies between agriculture and environment, and between urban and rural population. The mission, key topics and methods of research in order to understanding, monitoring and controlling processes in rural landscapes is being explained. Studies of international expert teams, many of them from Russia, demonstrate approaches towards both improving agricultural productivity and sustainability, and enhancing ecosystem services of agricultural landscapes. Scientists of different disciplines, decision makers, farmers and further informed people dealing with the evolvement of thriving rural landscapes are the primary audience of this book.
During the early 1990s, the Department of Defense (DoD) began to change its focus from the Cold War to pursue more diverse missions. Questions arose about how future changes in military missions, organizations, and technology would affect the nature of military work and the characteristics of the military and civilian members of the DoD workforce. To address these questions, RAND undertook an occupational-level analysis of the effects of the future environment on the characteristics of DoD work and workers.