Computational Chemistry and Molecular Modeling [electronic resource] : Principles and Applications

• Tác giả: Gopakumar Deepa, Krishnan Namboori, K. I Ramachandran
• ISBN-13: 978-3540773047
• Ký hiệu phân loại: 541.2 Theoretical chemistry
• Thông tin xuất bản: Berlin, Heidelberg : Springer Berlin Heidelberg : Imprint: Springer, 2008.
• Mô tả vật lý: XXII, 398 p. 111 illus., 21 illus. in color. , online resource.
• Bộ sưu tập: Tài liệu truy cập mở
• ID: 308508
• Chủ đề: 1. Chemistry, Physical and theoretical; 2. Chemistry-Data processing; 3. Chemometrics; 4. Physical chemistry; 5. Theoretical Chemistry

Tóm tắt

The gap between introductory level textbooks and highly specialized monographs is filled by this modern textbook. It provides in one comprehensive volume the in-depth theoretical background for molecular modeling and detailed descriptions of the applications in chemistry and related fields like drug design, molecular sciences, biomedical, polymer and materials engineering. Special chapters on basic mathematics and the use of respective software tools are included. Numerous numerical examples, exercises and explanatory illustrations as well as a web site with application tools (http://www.amrita.edu/cen/ccmm) support the students and lecturers.