Drug Design and Development

Drug Design and Development
Author: Chris Rostron
Publisher:
Total Pages: 371
Release: 2020-05-15
Genre:
ISBN: 0198749317

Drug Design and Development outlines the processes involved in the design and development of new drugs and emphasises the significance of these processes to the practice of pharmacy.

Computational Approaches for Understanding Dynamical Systems: Protein Folding and Assembly

Computational Approaches for Understanding Dynamical Systems: Protein Folding and Assembly
Author:
Publisher: Academic Press
Total Pages: 554
Release: 2020-03-05
Genre: Science
ISBN: 0128211377

Computational Approaches for Understanding Dynamical Systems: Protein Folding and Assembly, Volume 170 in the Progress in Molecular Biology and Translational Science series, provides the most topical, informative and exciting monographs available on a wide variety of research topics. The series includes in-depth knowledge on the molecular biological aspects of organismal physiology, with this release including chapters on Pairwise-Additive and Polarizable Atomistic Force Fields for Molecular Dynamics Simulations of Proteins, Scale-consistent approach to the derivation of coarse-grained force fields for simulating structure, dynamics, and thermodynamics of biopolymers, Enhanced sampling and free energy methods, and much more. - Includes comprehensive coverage on molecular biology - Presents ample use of tables, diagrams, schemata and color figures to enhance the reader's ability to rapidly grasp the information provided - Contains contributions from renowned experts in the field

Finite-Size Scaling

Finite-Size Scaling
Author: J. Cardy
Publisher: Elsevier
Total Pages: 385
Release: 2012-12-02
Genre: Computers
ISBN: 0444596062

Over the past few years, finite-size scaling has become an increasingly important tool in studies of critical systems. This is partly due to an increased understanding of finite-size effects by analytical means, and partly due to our ability to treat larger systems with large computers. The aim of this volume was to collect those papers which have been important for this progress and which illustrate novel applications of the method. The emphasis has been placed on relatively recent developments, including the use of the &egr;-expansion and of conformal methods.

Computer Simulation Studies in Condensed Matter Physics

Computer Simulation Studies in Condensed Matter Physics
Author: David P. Landau
Publisher: Springer Science & Business Media
Total Pages: 244
Release: 2012-12-06
Genre: Science
ISBN: 3642934005

Computer simulation studies in condensed matter physics form a rapidly developing field making sigificant contributions to important physical problems. The papers in this volume present new physical results and report new simulation techniques and new ways of interpreting simulational data, which cover simulation of both classical and quantum systems. Topics treated include - Multigrid and nonlocal updating methods in Monte Carlo simulations - Simulations of magnetic excitations and phase transitions - Simulations of aggregate formation - Molecular dynamics and Monte Carlo studies of polymers, polymer mixtures, and fluid flow - Quantum path integral and molecular dynamics studies of clusters and adsorbed layers on surfaces - New methods for simulating interacting boson and fermion systems - Simulational studies of electronic structure.

Computer Simulations of Surfaces and Interfaces

Computer Simulations of Surfaces and Interfaces
Author: Burkhard Dünweg
Publisher: Springer Science & Business Media
Total Pages: 480
Release: 2003-12-31
Genre: Computers
ISBN: 9781402014642

Proceedings of the NATO Advanced Study Institute, Albena, Bulgaria, from 9 to 20 September 2002

Computational Many-Particle Physics

Computational Many-Particle Physics
Author: Holger Fehske
Publisher: Springer
Total Pages: 774
Release: 2007-12-10
Genre: Science
ISBN: 3540746862

Looking for the real state of play in computational many-particle physics? Look no further. This book presents an overview of state-of-the-art numerical methods for studying interacting classical and quantum many-particle systems. A broad range of techniques and algorithms are covered, and emphasis is placed on their implementation on modern high-performance computers. This excellent book comes complete with online files and updates allowing readers to stay right up to date.

Ageing and the Glass Transition

Ageing and the Glass Transition
Author: Malte Henkel
Publisher: Springer
Total Pages: 361
Release: 2007-04-11
Genre: Science
ISBN: 3540696849

Understanding cooperative phenomena far from equilibrium is one of the fascinating challenges of present-day many-body physics. Glassy behaviour and the physical ageing process of such materials are paradigmatic examples. The present volume, primarily intended as introduction and reference, collects six extensive lectures addressing selected experimental and theoretical issues in the field of glassy systems.

Rugged Free Energy Landscapes

Rugged Free Energy Landscapes
Author: Wolfhard Janke
Publisher: Springer Science & Business Media
Total Pages: 411
Release: 2007-11-22
Genre: Science
ISBN: 3540740252

This collection of lectures and tutorial reviews focuses on the common computational approaches in use to unravel the static and dynamical behaviour of complex physical systems at the interface of physics, chemistry and biology. Prominent consideration is given to rugged free-energy landscapes. The authors aim to provide a common basis and technical language for the (computational) technology transfer between the fields and systems considered.

Path Integrals

Path Integrals
Author: Wolfhard Janke
Publisher: World Scientific
Total Pages: 629
Release: 2008
Genre: Science
ISBN: 9812837264

This proceedings volume contains selected talks and poster presentations from the 9th International Conference on Path Integrals ? New Trends and Perspectives, which took place at the Max Planck Institute for the Physics of Complex Systems in Dresden, Germany, during the period September 23?28, 2007. Continuing the well-developed tradition of the conference series, the present status of both the different techniques of path integral calculations and their diverse applications to many fields of physics and chemistry is reviewed. This is reflected in the main topics in this volume, which range from more traditional fields such as general quantum physics and quantum or statistical field theory through technical aspects like Monte Carlo simulations to more modern applications in the realm of quantum gravity and astrophysics, condensed matter physics with topical subjects such as Bose?Einstein condensation or quantum wires, biophysics and econophysics. All articles are successfully tied together by the common method of path integration; as a result, special methodological advancements in one topic could be transferred to other topics.