Current Trends In X Ray Crystallography

This book on X-ray Crystallography is a compilation of current trends in the use of X-ray crystallography and related structural determination methods in various fields. The methods covered here include single crystal small-molecule X-ray crystallography, macromolecular (protein) single crystal X-ray crystallography, and scattering and spectroscopic complimentary methods. The fields range from simple organic compounds, metal complexes to proteins, and also cover the meta-analyses of the database for weak interactions.

Reasoned and based on the difference between discovery and invention, according to the traditional conception, science can be distinguished between basic science and applied science. Nevertheless, we know that the sciences are inseparable. A century or more ago, Louis Pasteur said "there is no applied science, there are applications of science." With this assertion, he establishes the logic of complementarity between them. Science certainly goes beyond its own material application and brings us to issues that have intrigued humanity for a long time. During the many years that we have been working with techniques of material characterization, we observed that this complementarity was not always understood by the researchers. In line with the reasoning that the technique joined with science generates technology, the application of techniques that use x-ray and neutron sources seems to us of fundamental importance for the development of technology. In this way, we present in this book how the existing technology of material characterization can contribute to science and applied technology. The authors who contributed with this book sought to show the importance of applying the existing techniques in the development of their works.

X-ray Crystallography is a scientific technique used to demonstrate the arrangement of atoms of a crystalline solid in 3D space. This book is a collection of latest trends, using X-ray crystallography and related structural determination techniques in a diverse variety of spheres. The procedures emphasized in this book consist of various processes and spectroscopic complimentary methods. The spectrum ranges from basic organic compounds to metal complexes to proteins and includes meta-analyses of a host of weak connections.

Advances in Protein Molecular and Structural Biology Methods offers a complete overview of the latest tools and methods applicable to the study of proteins at the molecular and structural level. The book begins with sections exploring tools to optimize recombinant protein expression and biophysical techniques such as fluorescence spectroscopy, NMR, mass spectrometry, cryo-electron microscopy, and X-ray crystallography. It then moves towards computational approaches, considering structural bioinformatics, molecular dynamics simulations, and deep machine learning technologies. The book also covers methods applied to intrinsically disordered proteins (IDPs)followed by chapters on protein interaction networks, protein function, and protein design and engineering. It provides researchers with an extensive toolkit of methods and techniques to draw from when conducting their own experimental work, taking them from foundational concepts to practical application. Presents a thorough overview of the latest and emerging methods and technologies for protein study Explores biophysical techniques, including nuclear magnetic resonance, X-ray crystallography, and cryo-electron microscopy Includes computational and machine learning methods Features a section dedicated to tools and techniques specific to studying intrinsically disordered proteins

Chemical and Biochemical Approaches for the Study of Anesthetic Function, Part A, Volume 602 assembles new information on our understanding of anesthesia. This latest release in the series includes sections on how physical accuracy leads to biological relevance, best practices for simulating ligand-gated ion channels interacting with general anesthetics, computational approaches for studying voltage-gated ion channels modulation by general anesthetics, anesthetic parameterization, pharmacophore QSAR, QM, ONIOM, and kinetic modeling of electrophysiology data. We have selected the primary experts to write about each approach This provides one-stop shopping for all the means of addressing this complex question Anesthesia is enormously important as almost everybody receives it at some point

Computational Studies of Crystal Structure and Bonding, by Angelo Gavezzotti Cryo-Crystallography: Diffraction at Low Temperature and More, by Piero Macchi High-Pressure Crystallography, by Malcolm I. McMahon Chemical X-Ray Photodiffraction: Principles, Examples, and Perspectives, by Panče Naumov Powder Diffraction Crystallography of Molecular Solids, by Kenneth D. M. Harris

This comprehensive book presents a modern concept in biophysics based on recently published research. It highlights various aspects of the biophysical fundamentals and techniques that are currently used to study different physical properties of biomolecules, and relates the biological phenomenon with the underlying physical concepts. The content is divided into nine chapters summarizing the structural details of proteins, including recently discovered novel folds, higher order structures of nucleic acids, as well as lipids and the physical forces governing the macromolecular interactions which are essential for the various biological processes. It also provides insights into the recent advances in biophysical techniques including Hydrogen Deuterium Exchange with Mass Spectrometry (HDX-MS), Small angle X-ray scattering (SAXS) and Cryo Electron Microscopy (cryo EM), supplemented with interesting experimental data. It is a valuable reference resource for anyone with a desire to gain a better understanding of the fundamentals of biophysical concepts and techniques of important biomolecules.

Composites and nanocomposites are used in cases where long durability and strength of components are required; i.e., where high stress levels, erosion processes and multiphase environments are present, including the parts under collision and impact, the parts under rotating motion and erosion (like excavation drills in oil and gas wells). The first volume of this book aims to provide a guide for fabrication of new nanocomposites mainly based on carbon nanotubes and graphene. The main topics of this volume are: Application of Nano-powders for Formation of Metal Matrix of Composites, Conjugated Polymer Nanocomposites, Biopolymer Nanocomposites, Dental Nanocomposites, Graphene-based Nanocomposites for Electrochemical Energy Storage, Polymer/Filler Composites for Optical Diffuse Reflectors, Synthesis and Applications of LDH-Based Nanocomposites, Rubber—CNT Nanocomposites, Nanocomposite Fibers with Carbon Nanotubes, Fabrications of Graphene Based Nanocomposites for Electrochemical Sensing of Drug Molecules, Recent Advances in Graphene Metal Oxide Based Nanocomposites.