The application of mathematical models to molecules has now reached maturity. Scientists as diverse as astrophysicists, biologists, chemists, materials scientists and zoologists can reach for their PC, Mac or laptop to model molecular phenomena of unbelievable complexity. Following the highly successful first edition of Modelling Molecular Structures, this newly updated edition is your guide through the myriad of applications for molecular modelling. This easy-to-read, highly illustrated text covers all areas of molecular modelling, including molecular dynamics, quantum mechanics, and the Hartree-Fock self-consistent field model, providing background information and critically discussing the latest techniques in the field. Covering developments in the field since the first publication, this title also includes updated text and new material on: * Molecular Dynamics * Dealing with the Solvent This title is an indispensable introduction for all chemists, materials scientists, molecular biologists, and researchers working in, and interested in, the field of molecular modelling.
Type: BOOK - Published: 2000-09-21 - Publisher: John Wiley & Sons Incorporated
The application of mathematical models to molecules has now reached maturity. Scientists as diverse as astrophysicists, biologists, chemists, materials scientists and zoologists can reach for their PC, Mac or laptop to model molecular phenomena of unbelievable complexity. Following the highly successful first edition of Modelling Molecular Structures, this newly updated
Authors: Kevin Naidoo, John Brady, Martin Field, Jiali Gao, Michael Hann
Categories: Science
Type: BOOK - Published: 2007-10-31 - Publisher: Royal Society of Chemistry
Computational and theoretical tools for understanding biological processes at the molecular level is an exciting and innovative area of science. Using these methods to study the structure, dynamics and reactivity of biomacromolecules in solution, computational chemistry is becoming an essential tool, complementing the more traditional methods for structure and reactivity
Authors: Société française de chimie, J. Y. Lallemand
Categories: Science
Type: BOOK - Published: 1990 - Publisher: Elsevier Science Limited
The constant progress in computing techniques and supercomputers is now enhanced by very rapid advances in molecular graphics, which gives a fresh impetus to molecular modelling. The regular and fast expansion of knowledge is manifest in both applied and theoretical fields and in all aspects of chemistry. These proceedings present
This title is an indispensable introduction for all chemists, materials scientists, molecular biologists, and researchers working in, and interested in, the field of molecular modelling.