Analytical estimation of scaling behavior for the entanglement complexity of a bond network

被引:11
作者
Arteca, GA [1 ]
机构
[1] Laurentian Univ, Dept Chim & Biochim, Sudbury, ON P3E 2C6, Canada
来源
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES | 2002年 / 42卷 / 02期
关键词
D O I
10.1021/ci010338s
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Geometrical entanglements in a polymer network can be characterized in terms of the mean number of projected bond-bond crossings, N. Here, we present an analytical method to study the dependence of (N) over bar on the number of bonds in the network, n. Our approach shows the occurrence of power-law scaling, (N) over bar similar to n(beta). The estimated upper bound to the exponent for maximally compact networks, beta approximate to 1.38, agrees well with the values observed in simulations of transient networks in liquids and in the folding features of native states of globular proteins.
引用
收藏
页码:326 / 330
页数:5
相关论文
共 32 条
[1]  
Arnold I., 1986, SEL MATH SOV, V5, P327
[2]   Path-integral calculation of the mean number of overcrossings in an entangled polymer network [J].
Arteca, GA .
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES, 1999, 39 (03) :550-557
[3]   THE SHAPES OF BACKBONES OF CHAIN MOLECULES - 3-DIMENSIONAL CHARACTERIZATION BY SPHERICAL SHAPE MAPS [J].
ARTECA, GA ;
MEZEY, PG .
BIOPOLYMERS, 1992, 32 (12) :1609-1621
[4]   Temperature dependence of self-entanglements in protein backbones near the glass-like transition [J].
Arteca, GA ;
Caughill, DI .
CANADIAN JOURNAL OF CHEMISTRY, 1998, 76 (10) :1402-1409
[5]   SCALING BEHAVIOR OF SOME MOLECULAR SHAPE DESCRIPTORS OF POLYMER-CHAINS AND PROTEIN BACKBONES [J].
ARTECA, GA .
PHYSICAL REVIEW E, 1994, 49 (03) :2417-2428
[6]   OVERCROSSING SPECTRA OF PROTEIN BACKBONES - CHARACTERIZATION OF 3-DIMENSIONAL MOLECULAR SHAPE AND GLOBAL STRUCTURAL HOMOLOGIES [J].
ARTECA, GA .
BIOPOLYMERS, 1993, 33 (12) :1829-1841
[7]   Structural complexity of hydrogen-bonded networks [J].
Arteca, GA ;
Cachau, RE ;
Valuri, K .
CHEMICAL PHYSICS LETTERS, 2000, 319 (5-6) :719-724
[8]   A DETAILED SHAPE CHARACTERIZATION OF REGULAR POLYPEPTIDE CONFORMATIONS [J].
ARTECA, GA .
CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1995, 73 (02) :241-248
[9]   SCALING REGIMES SELF-ENTANGLEMENTS IN VERY COMPACT PROTEINS [J].
ARTECA, GA .
PHYSICAL REVIEW E, 1995, 51 (03) :2600-2610
[10]   Compaction of grafted wormlike chains under variable confinement [J].
Arteca, GA ;
Edvinsson, T ;
Elvingson, C .
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2001, 3 (17) :3737-3741