The SHELX-97 Manual
Contents
1. General Introduction to SHELX-97
2. SHELXL: Structure refinement
3. Examples of Small Molecule Refinements with SHELXL
4. Constraints and Hydrogen Atoms
6. Refinement of Twinned Structures; Absolute Structure
8. Strategies for Macromolecular Refinement
9. SHELXPRO: Protein Interface to SHELX-97
10. SHELXWAT: Automated Water Divining
11. Examples of Macromolecular Refinement
12. SHELXS - Structure Solution
13. Structure Solution by Direct Methods
14. Patterson Interpretation and Partial Structure Expansion
15. Location of Heavy Atoms from Protein D F Data
16. CIF, CIFTAB and Electronic Publication
17. SHELXA: Empirical Absorption Corrections