Molecular dynamics MD simulations in conjunction with the thermodynamic cycle perturbation approach has been used to calculate relative solvation free energies for acetone to acetaldehyde, acetone to pyruvic acid, acetone to 1,1,1-trifluoroacetone, acetone to 1,1,1-trichloroacetone, acetone to 2,3-b
β¦ LIBER β¦
Free Energy Difference Calculations on Thermodynamic Model of Beta 2 Adrenergic Receptor Activation
β Scribed by Chief Elk, Jackson; Sprang, Stephen R.; Ross, J.B. Alexander
- Book ID
- 122077284
- Publisher
- Biophysical Society
- Year
- 2012
- Tongue
- English
- Weight
- 34 KB
- Volume
- 102
- Category
- Article
- ISSN
- 0006-3495
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