Computational approaches to biochemical reactivity /
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| Imprint: | Dordrecht ; Boston : Kluwer Academic, c1997. |
|---|---|
| Description: | x, 379 p. : ill. ; 25 cm. |
| Language: | English |
| Series: | Understanding chemical reactivity. v. 19 |
| Subject: | |
| Format: | Print Book |
| URL for this record: | http://pi.lib.uchicago.edu/1001/cat/bib/2887062 |
Table of Contents:
- Preface / A. Warshel and G. Naray-Szabo
- 1. Quantum mechanical models for reactions in solution / J. Tomasi, B. Mennucci and R. Cammi [et al.]
- 2. Free energy perturbation calculations within quantum mechanical methodologies / R. V. Stanton, S. L. Dixon and K. M. Merz, Jr.
- 3. Hybrid potentials for molecular systems in the condensed phase / M. J. Field
- 4. Molecular mechanics and dynamics simulations of enzymes / R. H. Stote, A. Dejaegere and M. Karplus
- 5. Electrostatic interactions in proteins / K. A. Sharp
- 6. Electrostatic basis of enzyme catalysis / G. Naray-Szabo, M. Fuxreiter and A. Warshel
- 7. On the mechanisms of proteinases / A. Goldblum
- 8. Modelling of proton transfer reactions in enzymes / J. Aqvist
- 9. Protein-ligand interactions / T. P. Lybrand.
