The most successful computational approach to the conformational analysis of medium-sized molecules with 30-40 atoms or more is presently based on molecular mechanics and empirical force fields. Because of their empirical nature, these procedures can at times lead to rather inconclusive results. In
β¦ LIBER β¦
Ab initio molecular packing analysis
β Scribed by Williams, D. E.
- Book ID
- 114513903
- Publisher
- International Union of Crystallography
- Year
- 1996
- Tongue
- English
- Weight
- 334 KB
- Volume
- 52
- Category
- Article
- ISSN
- 0108-7673
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