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Molecular modeling

Author: Peter Comba; Trevor W Hambley
Publisher: Weinheim ; New York : VCH, ©1995.
Edition/Format:   Print book : EnglishView all editions and formats
Database:WorldCat
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Additional Physical Format: Online version:
Comba, Peter.
Molecular modeling.
Weinheim ; New York : VCH, ©1995
(OCoLC)624623934
Material Type: Internet resource
Document Type: Book, Internet Resource
All Authors / Contributors: Peter Comba; Trevor W Hambley
ISBN: 3527290761 9783527290765
OCLC Number: 32822432
Description: x, 197 pages ; 25 cm
Contents: 1. Introduction --
2. Parameterization, Approximations and Limitations --
3. Computation --
4. The Multiple Minima Problem --
5. Conclusions --
6. Structural Aspects --
7. Stereoselectivities --
8. Metal Ion Selectivity --
9. Spectroscopy --
10. Electron Transfer --
11. Electronic Effects --
12. Bioinorganic Chemistry --
13. Organometallics --
14. Compounds with s, p and f Block Elements --
15. Developing a Force Field --
16. Carrying Out the Calculations --
17. Interpreting and Using the Results --
Fundamental Constants, Units and Conversion Factors --
Software and Force Fields.
Other Titles: Molecular modeling of inorganic compounds
Responsibility: Peter Comba, Trevor W. Hambley.
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