A generalized born implicit-membrane representation compared to experimental insertion free energies.

An implicit-membrane representation based on the generalized Born theory of solvation has been developed. The method was parameterized against the water-to-cyclohexane insertion free energies of hydrophobic side-chain analogs. Subsequently, the membrane was compared with experimental data from trans...

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Hlavní autoři: Ulmschneider, M, Ulmschneider, J, Sansom, MS, Di Nola, A
Médium: Journal article
Jazyk:English
Vydáno: 2007