Nanotechnology and In Silico Tools: Natural Remedies and Drug Discovery provides the latest information and updates in the area of drug discovery. It covers aspects like nanomedicines, bioinformatics, molecular docking, molecular modeling, QSAR, virtual screening and computational chemistry as well as metabolomics research using various tools. The drug discovery process accelerates the design of new leads for various life-threatening diseases and natural medicines. Silico tools have been an integral part of the drug discovery process, playing a major role as a template for drug discovery and offering a holistic approach to better management of various diseases. Nanotechnology and In Silico Tools: Natural Remedies and Drug Discovery combines the principles of natural medicines with refined modern technology to help chemists in the development of a more ecofriendly, and effective discovery process. - Combines principles of natural medicines with refined modern technology - Provides the latest updates on drug discovery - Covers technologies for synthetic products that can be applied for the investigation of plant-derived natural remedies

ß-barrel outer membrane channel proteins (OMP) are useful as robust and flexible models or components in nanotechnology. Over the last decade biotechnological techniques allowed to expand the natural characteristics of OMPs by modifying their geometry and properties. The present book is oriented towards a broad group of readers including graduate students and advanced researchers. It gives a general introduction to the field of OMP based nano-component development as well as the state of the art of the involved research. On the example of the E. coli FhuA the transformation of an OMP into a tailored nano-channel will be outlined. An exhaustive description of the scientific strategy, including protein selection, analytical methods and “in-silico” tools to support the planning of protein modifications for a targeted application, consideration on the production of a custom made OMP, and an overview on technological applications including membrane/polymersome technology, will be provided.

Focusing on phytochemicals and their potential for drug discovery, this book offers a comprehensive resource on poisonous plants and their applications in chemistry and in pharmacology. Provides a comprehensive resource on phytotoxins, covering historical perspectives, modern applications, and their potential in drug discovery Covers the mechanisms, benefits, risks and management protocols of phytotoxins in a scientific laboratory and the usefulness in drug discovery Presents chapters in a carefully designed, clear order, making it an ideal resource for the academic researcher or the industry professional at any stage in their career

This book reports on cutting-edge modeling techniques, methodologies and tools used to understand, design and engineer nanoscale communication systems, such as molecular communication systems. Moreover, it includes introductory materials for those who are new to the field. The book’s interdisciplinary approach, which merges perspectives in computer science, the biological sciences and nanotechnology, will appeal to graduate students and researchers in these three areas.The book is organized into five parts, the first of which describes the fundamentals of molecular communication, including basic concepts, models and designs. In turn, the second part examines specific types of molecular communication found in biological systems, such as neuronal communication in the brain. The book continues by exploring further types of nanoscale communication, such as fluorescence resonance energy transfer and electromagnetic-based nanoscale communication, in the third part, and by describing nanomaterials and structures for practical applications in the fourth. Lastly, the book presents nanomedical applications such as targeted drug delivery and biomolecular sensing.

The Finite Difference Time Domain (FDTD) method is an essential tool in modeling inhomogeneous, anisotropic, and dispersive media with random, multilayered, and periodic fundamental (or device) nanostructures due to its features of extreme flexibility and easy implementation. It has led to many new discoveries concerning guided modes in nanoplasmonic waveguides and continues to attract attention from researchers across the globe. Written in a manner that is easily digestible to beginners and useful to seasoned professionals, Computational Nanotechnology Using Finite Difference Time Domain describes the key concepts of the computational FDTD method used in nanotechnology. The book discusses the newest and most popular computational nanotechnologies using the FDTD method, considering their primary benefits. It also predicts future applications of nanotechnology in technical industry by examining the results of interdisciplinary research conducted by world-renowned experts. Complete with case studies, examples, supportive appendices, and FDTD codes accessible via a companion website, Computational Nanotechnology Using Finite Difference Time Domain not only delivers a practical introduction to the use of FDTD in nanotechnology but also serves as a valuable reference for academia and professionals working in the fields of physics, chemistry, biology, medicine, material science, quantum science, electrical and electronic engineering, electromagnetics, photonics, optical science, computer science, mechanical engineering, chemical engineering, and aerospace engineering.

This volume presents a comprehensive perspective on the global scientific, technological, and societal impact of nanotechnology since 2000, and explores the opportunities and research directions in the next decade to 2020. The vision for the future of nanotechnology presented here draws on scientific insights from U.S. experts in the field, examinations of lessons learned, and international perspectives shared by participants from 35 countries in a series of high-level workshops organized by Mike Roco of the National Science Foundation (NSF), along with a team of American co-hosts that includes Chad Mirkin, Mark Hersam, Evelyn Hu, and several other eminent U.S. scientists. The study performed in support of the U.S. National Nanotechnology Initiative (NNI) aims to redefine the R&D goals for nanoscale science and engineering integration and to establish nanotechnology as a general-purpose technology in the next decade. It intends to provide decision makers in academia, industry, and government with a nanotechnology community perspective of productive and responsible paths forward for nanotechnology R&D.

This book highlights recent advances in variety of nanomaterials classes including metal chalcogenides, metal oxides/hydroxides, polymer, metal-organic frameworks, and hybrid nanostructures, with a focus on their properties, synthesis methods, and key applications. It also offers detailed coverage on the toxicity aspects with possible solution. Additionally, it provides complete and comprehensive information on surface modification strategies of nanoparticles to achieve desired outcomes. This book discusses potential applications and major challenges of using these nanomaterials in the fields of biomedical sciences, agricultural industry, bioenergy, biofuel production, and environmental remediation, etc. Overall, this book provides crucial background in nanobiotechnology that compliments the understanding of experimental design for the production of more customized nanomaterials to avail desirable benefits.