Empirical calculation of the relative fr
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Patrik Kasper; Philipp Christen; Heinz Gehring
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Article
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2000
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John Wiley and Sons
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English
β 269 KB
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We describe a methodology to calculate the relative free energies of protein-peptide complex formation. The interaction energy was decomposed into nonpolar, electrostatic and entropic contributions. A free energy-surface area relationship served to calculate the nonpolar free energy term. The electr