MONTE-CARLO SIMULATIONS OF OFF-LATTICE POLYMERS

被引:18
作者
GRASSBERGER, P
HEGGER, R
机构
[1] Dept. of Phys., Wuppertal Univ.
关键词
D O I
10.1088/0953-8984/7/16/005
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
We point out that a newly introduced recursive algorithm for lattice polymers has a much wider range of applicability. In particular, we apply it to the simulation of off-lattice polymers with Lennard-Jones potentials between non-bonded monomers and either delta or harmonic potentials between bonded monomers. Our algorithm allows particularly easy calculations of the free energy, and seems in general more efficient than other existing algorithms.
引用
收藏
页码:3089 / 3097
页数:9
相关论文
共 31 条
[1]   ESTIMATION OF THE CHEMICAL-POTENTIAL OF CHAIN MOLECULES BY SIMULATION [J].
DEPABLO, JJ ;
LASO, M ;
SUTER, UW .
JOURNAL OF CHEMICAL PHYSICS, 1992, 96 (08) :6157-6162
[2]  
FRENKEL D, 1991, J PHYS-CONDENS MAT, V3, P3053
[3]  
GAREL T, 1990, J PHYS A, V26, pL621
[4]   RECURSIVE SAMPLING OF RANDOM-WALKS - SELF-AVOIDING WALKS IN DISORDERED MEDIA [J].
GRASSBERGER, P .
JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL, 1993, 26 (05) :1023-1036
[5]   SELF-AVOIDING WALKS IN 4 DIMENSIONS - LOGARITHMIC CORRECTIONS [J].
GRASSBERGER, P ;
HEGGER, R ;
SCHAFER, L .
JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL, 1994, 27 (22) :7265-7282
[6]  
GRASSBERGER P, 1995, IN PRESS PHYS REV E
[7]  
Grassberger P., 1994, J PHYS A, V27, P4069
[8]  
GRASSBERGER P, 1995, IN PRESS J CHEM PHYS
[9]   MEAN-SQUARE ENDPOINT SEPARATION OF OFF-LATTICE SELF-AVOIDING WALKS [J].
GRISHMAN, R .
JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (01) :220-225
[10]   A LATTICE MODEL OF A SUPPORTED MONOLAYER OF AMPHIPHILE MOLECULES - MONTE-CARLO SIMULATIONS [J].
HARRIS, J ;
RICE, SA .
JOURNAL OF CHEMICAL PHYSICS, 1988, 88 (02) :1298-1306