COMPARISON OF FREE-ENERGY SURFACES FOR EXTENDED-ATOM AND ALL-ATOM MODELS OF NORMAL-BUTANE

被引:15
|
作者
BELL, CD [1 ]
HARVEY, SC [1 ]
机构
[1] UNIV ALABAMA, DEPT BIOCHEM, BIRMINGHAM, AL 35294 USA
来源
JOURNAL OF PHYSICAL CHEMISTRY | 1986年 / 90卷 / 25期
关键词
D O I
10.1021/j100283a001
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
引用
收藏
页码:6595 / 6597
页数:3
相关论文
共 50 条
  • [1] All-atom calculation of protein free-energy profiles
    Orioli, S.
    Ianeselli, A.
    Spagnolli, G.
    Faccioli, P.
    JOURNAL OF CHEMICAL PHYSICS, 2017, 147 (15):
  • [2] All-Atom Protein Folding with Free-Energy Forcefields
    Verma, A.
    Gopal, S. M.
    Schug, A.
    Herges, T.
    Klenin, K.
    Wenzel, W.
    MOLECULAR BIOLOGY OF PROTEIN FOLDING, PT A, 2008, 83 : 181 - +
  • [3] A Free-Energy Approach for All-Atom Protein Simulation
    Verma, Abhinav
    Wenzel, Wolfgang
    BIOPHYSICAL JOURNAL, 2009, 96 (09) : 3483 - 3494
  • [4] Free-energy function based on an all-atom model for proteins
    Yoshidome, Takashi
    Oda, Koji
    Harano, Yuichi
    Roth, Roland
    Sugita, Yuji
    Ikeguchi, Mitsunori
    Kinoshita, Masahiro
    PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2009, 77 (04) : 950 - 961
  • [5] Protein structure prediction by all-atom free-energy refinement
    Verma, Abhinav
    Wenzel, Wolfgang
    BMC STRUCTURAL BIOLOGY, 2007, 7
  • [6] Predictive folding of a β-hairpin protein in an all-atom free-energy model
    Wenzel, W.
    EUROPHYSICS LETTERS, 2006, 76 (01): : 156 - 162
  • [7] Free-energy landscape of the villin headpiece in an all-atom force field
    Herges, T
    Wenzel, W
    STRUCTURE, 2005, 13 (04) : 661 - 668
  • [8] Free-energy landscape of the villin headpiece in an all-atom force field
    不详
    EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, 2005, 34 (06): : 796 - 796
  • [9] All-atom protein folding using an improved free-energy forcefield.
    Verma, Abhinav
    Wenzel, Wolfgang
    BIOPHYSICAL JOURNAL, 2007, : 214A - 214A
  • [10] Modeling and Simulation of Rodlet Assembly of Hydrophobin EAS in an All-Atom Free-Energy Forcefield
    Strunk, Timo
    Wenzel, Wolfgang
    BIOPHYSICAL JOURNAL, 2010, 98 (03) : 634A - 635A