The Alzheimer's β amyloid (Aβ1-39) monomer in an implicit solvent

被引:22
作者
Anand, Priya [1 ,2 ]
Nandel, F. S. [2 ]
Hansmann, Ulrich H. E. [1 ,3 ]
机构
[1] Forschungszentrum Julich, John von Neumann Inst Computing, D-52425 Julich, Germany
[2] Panjab Univ, Dept Biophys, Chandigarh 160014, India
[3] Michigan Technol Univ, Dept Phys, Houghton, MI 49931 USA
关键词
D O I
10.1063/1.2907718
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Results from replica-exchange and regular room temperature molecular dynamics simulations of the Alzheimer's beta amyloid (A beta(1-39)) monomer in an implicit solvent are reported. Our data indicate that at room temperature, the monomer assumes random-coil and soluble conformations. No beta content is observed which therefore seems to be a product of oligomerization and aggregation of monomers. (c) 2008 American Institute of Physics.
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页数:5
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