Computer-Aided Drug Molecular Design

Author: Xu Xiaojie
Publisher:
Publish Date: 2004-07-01
Features: Since the 1990s, with the development of computer technology and the advancement of drug chemistry, molecular biology, and computational chemistry, computer-aided drug molecule design (CADD) has evolved into a mature and emerging research field. At the same time, the development and application of CADD have significantly improved the efficiency of drug design and new drug development. CADD has become an indispensable part of rational drug design, playing an increasingly important role in drug design. Therefore, the theoretical and applied research of CADD methods holds great significance. There are still few specialized books on this topic in China. The author, based on the work of their research group and referencing a large number of literature and research examples, provides a systematic and detailed exposition of CADD methods. This book introduces both traditional and some new methods of CADD, and elaborates on the basic and specific operations of drug design with numerous examples, making it a work that combines theory and practice. This book serves as a highly valuable reference for researchers and educators engaged in drug research. The theoretical computational methods discussed in this book also hold significant reference value for researchers in computer chemistry, computational biology, chemical informatics, and bioinformatics. Additionally, this book can serve as a reference for undergraduate and graduate students majoring in pharmaceutical chemistry, theoretical chemistry, and molecular biology.
Since the 1990s, with the development of computer technology and the advancement of drug chemistry, molecular biology, and computational chemistry, computer-aided drug molecule design (CADD) has evolved into a mature and emerging research field. At the same time, the development and application of CADD have significantly improved the efficiency of drug design and new drug development. CADD has become an indispensable part of rational drug design, playing an increasingly important role in drug design. Therefore, the theoretical and applied research of CADD methods holds great significance. There are still few specialized books on this topic in China. The author, based on the work of their research group and referencing a large number of literature and research examples, provides a systematic and detailed exposition of CADD methods. This book introduces both traditional and some new methods of CADD, and elaborates on the basic and specific operations of drug design with numerous examples, making it a work that combines theory and practice. This book serves as a highly valuable reference for researchers and educators engaged in drug research. The theoretical computational methods discussed in this book also hold significant reference value for researchers in computer chemistry, computational biology, chemical informatics, and bioinformatics. Additionally, this book can serve as a reference for undergraduate and graduate students majoring in pharmaceutical chemistry, theoretical chemistry, and molecular biology.