Free energy of charge transfer and intraprotein electric field: method of calculation depends on the charge state of protein at a given structure
β Scribed by Edward L. Mertz; Lev I. Krishtalik
- Book ID
- 108431317
- Publisher
- Elsevier Science
- Year
- 1999
- Tongue
- English
- Weight
- 113 KB
- Volume
- 48
- Category
- Article
- ISSN
- 1567-5394
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## Abstract The oneβstep free energy perturbation approach can be applied to obtain conformational stateβspecific free energy differences (FEDs) associated with changes in force field parameters, and thus offers the possibility to consider conformational equilibria during force field parameterizati