Modeling water-protein interactions in a protein crystal
β Scribed by Hermans, Jan; Vacatello, Michele
- Book ID
- 118517745
- Publisher
- Biophysical Society
- Year
- 1980
- Tongue
- English
- Weight
- 129 KB
- Volume
- 32
- Category
- Article
- ISSN
- 0006-3495
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π SIMILAR VOLUMES
The determination of free energies that govern protein-protein recognition is essential for a detailed molecular understanding of biological specificity. Continuum models of macromolecular interactions, in which the solvent is treated by an implicit representation and the proteins are treated semi-m
We re"ne a protein model that reproduces fundamental aspects of protein thermodynamics. The model exhibits two transitions, hot and cold unfolding. The number of relevant parameters is reduced to three: (1) binding energy of folding relative to the orientational energy of bound water, (2) ratio of d