Generalized coarse-grained model based on Gay-Berne and point multipole potentials

被引：0
作者：
Golubkov, Pavel A. [1 ]
Ren, Pengyu [1 ]
机构：
[1] Univ Texas Austin, Dept Biomed Engn, Austin, TX 78712 USA
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2006年 / 232卷
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
29-COMP
引用
收藏
页码：274 / 274
页数：1
相关论文
共 50 条
[41]   Developing Bonded Potentials for a Coarse-Grained Model of Intrinsically Disordered Proteins [J].
Rizuan, Azamat ;
Jovic, Nina ;
Phan, Tien M. ;
Kim, Young C. ;
Mittal, Jeetain .
Journal of Chemical Information and Modeling, 2022, 62 (18) :4474-4485
[42]   A deformable Gay-Berne model for the simulation of liquid crystals and soft materials [J].
Muccioli, Luca ;
Zannoni, Claudio .
CHEMICAL PHYSICS LETTERS, 2006, 423 (1-3) :1-6
[43]   Lines of invariant physics in the isotropic phase of the discotic Gay-Berne model [J].
Mehri, Saeed ;
Kolmangadi, Mohamed A. ;
Dyre, Jeppe C. ;
Ingebrigtsen, Trond S. .
JOURNAL OF NON-CRYSTALLINE SOLIDS-X, 2022, 14
[44]   Developing Bonded Potentials for a Coarse-Grained Model of Intrinsically Disordered Proteins [J].
Rizuan, Azamat ;
Jovic, Nina ;
Phan, Tien M. ;
Kim, Young C. ;
Mittal, Jeetain .
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2022, :4474-4485
[45]   Modified Fast Multipole Method for Coarse-Grained Molecular Simulations [J].
Poursina, Mohammad .
BIOPHYSICAL JOURNAL, 2014, 106 (02) :407A-407A
[46]   Theory for the liquid-crystalline phase behavior of the Gay-Berne model [J].
Velasco, E. ;
Mederos, L. .
Journal of Chemical Physics, 1998, 109 (06)
[47]   Highlighting a link between the Gay-Berne potential and the bold flocking model [J].
Scarle, Simon .
SIMULATION-TRANSACTIONS OF THE SOCIETY FOR MODELING AND SIMULATION INTERNATIONAL, 2006, 82 (10) :627-633
[48]   A Generalized-Yvon-Born-Green Theory for Determining Coarse-Grained Interaction Potentials [J].
Mullinax, J. W. ;
Noid, W. G. .
JOURNAL OF PHYSICAL CHEMISTRY C, 2010, 114 (12) :5661-5674
[49]   Coarse-grained protein model coupled with a coarse-grained water model: Molecular dynamics study of polyalanine-based peptides [J].
Han, Wei ;
Wu, Yun-Dong .
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2007, 3 (06) :2146-2161
[50]   Parameterization of a coarse-grained model of cholesterol with point-dipole electrostatics [J].
P. Siani ;
H. Khandelia ;
M. Orsi ;
L. G. Dias .
Journal of Computer-Aided Molecular Design, 2018, 32 :1259-1271
12345