Chemoinformatics: Second Edition

Author: Shao Xueguang
Publisher:
Publish Date: 2006-01-24
Features: This book first briefly introduces the basic usage of the Unix system, as well as common programming languages and techniques. It then provides an introduction to Internet services, the use and search of Internet resources. Chapters 2, 3, 4, and 5 respectively detail the methods of searching for and using chemical resources on the Internet. Chapter 6 comprehensively introduces the computer representation, management, and application of chemical information. Chapter 7 covers computer simulation methods in the fields of chemistry and biochemistry, as well as their applications in spectral simulation and molecular simulation. Chapters 8, 9, 10, 11, and 12 respectively provide detailed discussions on common chemometrics methods and their applications.