New mechanism of catalytic GTP hydrolysis: Quantum and molecular dynamics simulations.

被引:0
|
作者
Alexeev, Y
Windus, TL
Valiev, M
Dixon, DA
机构
[1] Pacific NW Natl Lab, Mol Sci Software Grp, Richland, WA 99352 USA
[2] Univ Calif San Diego, Dept Chem, La Jolla, CA 92093 USA
[3] Univ Alabama, Dept Chem, Tuscaloosa, AL 35487 USA
来源
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2004年 / 228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
643-PHYS
引用
收藏
页码:U296 / U296
页数:1
相关论文
共 50 条
  • [41] Comparing automatic transmission fluid additive effects via molecular dynamics simulations.
    Greenfield, ML
    Ohtani, H
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 220 : U186 - U187
  • [42] Short-time local dynamics of ionic liquids: Neutron scattering and molecular dynamics simulations.
    Morrow, TI
    Maginn, EJ
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2003, 226 : U645 - U645
  • [43] Comparison of the DHFR wildtype and the val-121 mutant molecular dynamics simulations.
    Radkiewicz, JL
    Brooks, CL
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 219 : U597 - U598
  • [44] Domain motions in phosphoglycerate kinase using heirarchical NEIMO molecular dynamics simulations.
    Vaidehi, N
    McPhillips, T
    Goddard, WA
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1998, 216 : U752 - U752
  • [45] STRUCTURE OF AQUEOUS ELECTROLYTE SOLUTIONS AS DERIVED FROM MD (MOLECULAR DYNAMICS) SIMULATIONS.
    Heinzinger, Karl
    1600, (57):
  • [46] N-heptane under pressure: Structure and dynamics from molecular simulations.
    Sundaram, B
    Krishnan, M
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2005, 229 : U743 - U743
  • [47] Structural characteristics of 2′ sugar substituted oligonucleotides from molecular dynamics simulations.
    Lind, KE
    Mohan, V
    Manoharan, M
    Ferguson, DM
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1998, 216 : U752 - U752
  • [48] Describing protein folding kinetics by molecular dynamics simulations. 1. Theory
    Swope, WC
    Pitera, JW
    Suits, F
    JOURNAL OF PHYSICAL CHEMISTRY B, 2004, 108 (21): : 6571 - 6581
  • [49] Role of histidine-85 in the catalytic mechanism of thymidine phosphorylase as assessed by targeted molecular dynamics simulations and quantum mechanical calculations
    Mendieta, J
    Martín-Santamaría, S
    Priego, EM
    Balzarini, J
    Camarasa, MJ
    Pérez-Pérez, MJ
    Gago, F
    BIOCHEMISTRY, 2004, 43 (02) : 405 - 414
  • [50] A reversible algorithm for Nose molecular dynamics simulations. Equilibrium properties of liquid methane
    Tchouar, N.
    Benyettou, M.
    Baghli, H.
    JOURNAL OF MOLECULAR LIQUIDS, 2007, 136 (1-2) : 5 - 10