Optimization of the SREX reagent using a molecular-mechanics model.

被引:0
|
作者
Hay, BP
Dietz, ML
Horwitz, EP
机构
[1] Pacific NW Lab, Environm Mol Sci Lab, Richland, WA 99352 USA
[2] Argonne Natl Lab, Div Chem, Argonne, IL 60439 USA
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
165-IEC
引用
收藏
页码:U748 / U748
页数:1
相关论文
共 50 条
  • [41] SYSTEMS OPTIMIZATION OF THE PARAMETERS OF A PREDICTION MODEL.
    Svetal'skiy, B.K.
    Stepashko, V.S.
    Soviet journal of automation and information sciences, 1986, 19 (06): : 72 - 74
  • [42] FACILITY SELECTION AND HAUL OPTIMIZATION MODEL.
    Esmaili, Houshang
    American Society of Civil Engineers, Journal of the Sanitary Engineering Division (Changed to American Society of Civil Engineers, Journal of the Environmental Engineering Division), 1972, 98 (SA6): : 1005 - 1020
  • [43] Elucidation of metal-dependent, molecular-mechanics parameters through analysis of forces in the coordination sphere.
    Pletnev, IV
    Razumov, MG
    Otkidach, DS
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 219 : U733 - U733
  • [44] Molecular dynamics studies of the electrostatics of micellar interfaces using a polarizable model.
    Shelley, JC
    Sprik, M
    Klein, ML
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1997, 214 : 92 - COMP
  • [45] Optimization of solvent extraction systems using molecular mechanics methods.
    Dietz, ML
    Bond, AH
    Chiarizia, R
    Herlinger, AW
    Huber, VJ
    Hay, BP
    Finch, JW
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 220 : U419 - U419
  • [46] Dual Photochemical Reaction Pathway in Flavin-Based Photoreceptor LOV Domain: A Combined Quantum-Mechanics/Molecular-Mechanics Investigation
    Nakagawa, Setsuko
    Weingart, Oliver
    Marian, Christel M.
    JOURNAL OF PHYSICAL CHEMISTRY B, 2017, 121 (41): : 9583 - 9596
  • [47] Molecular weight distributions: A simple model.
    Rodriguez, F
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 228 : U518 - U518
  • [48] DETERMINISTIC GLOBAL OPTIMIZATION AND MOLECULAR MECHANICS
    SAHINIDIS, NV
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1993, 206 : 90 - COMP
  • [49] OPTIMIZATION OF ROAD INVESTMENTS BASED ON ACCESSIBILITY CRITERIA USING A DYNAMIC PROGRAMMING MODEL.
    Schnuerer, Herwig
    1600, (09):
  • [50] MOLECULAR-MECHANICS MODELING OF DRUG-DNA STRUCTURES - THE EFFECTS OF DIFFERING DIELECTRIC TREATMENT ON HELIX PARAMETERS AND COMPARISON WITH A FULLY SOLVATED STRUCTURAL MODEL
    OROZCO, M
    LAUGHTON, CA
    HERZYK, P
    NEIDLE, S
    JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 1990, 8 (02): : 359 - 373