混合リン脂質二重層膜の分子動力学シミュレーション(生体(2),一般講演)

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  • Molecular Dynamics Simulation of a Mixed-lipids Bilayer

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The molecular structures of a mixed-lipid bilayer are investigated by means of molecular dynamics simulations. The hydrated mixed-lipid bilayer calculated here is the binary lipids bilayer consisting of dipalmitoyl phosphatidylcholine (DPPC) and palmitoyl-oleyle-phophochline (POPC) at the equal molar ratio. The area per lipid of the binary lipids bilayer is estimated to be 0.61nm^2 which is smaller than that of the pure DPPC or POPC bilayer. In addition, the deuterium order parameters of DPPC and POPC hydrophobic chains become larger in the binary lipids bilayer.

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