Inclusion complexes behavior at the air-water interface. Molecular dynamic simulation study

被引:0
|
作者
Gargallo, L. [1 ]
Vargas, D. [1 ]
Sandoval, C. [1 ]
Saavedra, M. [1 ]
Becerra, N. [1 ]
Leiva, A. [1 ]
Radic, D. [1 ]
机构
[1] Pontificia Univ Catolica Chile, Fac Quim, Dept Quim Fis, Casilla 306, Santiago 22, Chile
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中图分类号
V [航空、航天];
学科分类号
08 ; 0825 ;
摘要
The interfacial properties of the inclusion complexes (ICs), obtained from the threading of a-cyclodextrin (alpha-CD) onto poly(ethylene-oxide)(PEO), poly(epsilon-caprolactone)(PEC) and poly(tetrahydrofuran)(PTHF) and their precursor homopolymers (PHPoly), were studied at the air-water interface. The free surface energy was determined by wettability measurements. The experimental behavior of these systems was described by an atomistic molecular dynamics simulation (MDS).
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页码:38 / +
页数:2
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