ON THE GRAPHICAL DISPLAY OF MOLECULAR ELECTROSTATIC FORCE-FIELDS AND GRADIENTS OF THE ELECTRON-DENSITY

被引:28
|
作者
PURVIS, GD
CULBERSON, C
机构
来源
JOURNAL OF MOLECULAR GRAPHICS | 1986年 / 4卷 / 02期
关键词
D O I
10.1016/0263-7855(86)80003-0
中图分类号
Q5 [生物化学];
学科分类号
071010 ; 081704 ;
摘要
引用
收藏
页码:88 / &
相关论文
共 50 条
  • [21] A Comparison of Classical Force-Fields for Molecular Dynamics Simulations of Lubricants
    Ewen, James P.
    Gattinoni, Chiara
    Thakkar, Foram M.
    Morgan, Neal
    Spikes, Hugh A.
    Dini, Daniele
    MATERIALS, 2016, 9 (08):
  • [22] VALENCE FORCE-FIELDS AS A TOOL IN VIBRATIONAL SPECTROSCOPY AND MOLECULAR MECHANICS
    PALMO, K
    PIETILA, LO
    MANNFORS, B
    CROATICA CHEMICA ACTA, 1988, 61 (03) : 605 - 620
  • [23] A CRITICAL-EVALUATION OF VARIOUS FORCE-FIELDS IN MOLECULAR MECHANICS
    DASGUPTA, S
    GODDARD, WA III
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1988, 195 : 23 - PHYS
  • [24] MEASUREMENT OF ELECTRON-DENSITY GRADIENTS USING A MODIFIED JAMIN INTERFEROMETER
    WOOLSEY, GA
    ILLINGWORTH, R
    JOURNAL OF PHYSICS E-SCIENTIFIC INSTRUMENTS, 1972, 5 (06): : 575 - +
  • [25] ELECTROSTATIC MOLECULAR-POTENTIAL ANALYSIS OF ELECTRON-DENSITY DISTRIBUTION IN (HALME2)2
    OKNINSKI, A
    PASYNKIEWICZ, S
    ADVANCES IN MOLECULAR RELAXATION AND INTERACTION PROCESSES, 1980, 16 (02): : 101 - 109
  • [26] MEASUREMENT OF ELECTRON-DENSITY IN A CYLINDRICAL ELECTROSTATIC PLASMA CONFINEMENT DEVICE
    MEEKER, DJ
    VERDEYEN, JT
    CHERRING.BE
    BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1972, 17 (11): : 1019 - 1019
  • [27] DISPLAY AND INTERPRETATION OF SOLVENT ELECTRON-DENSITY DISTRIBUTIONS IN INSULIN CRYSTALS
    BADGER, J
    JOURNAL OF MOLECULAR GRAPHICS, 1993, 11 (04): : 218 - 221
  • [28] ELECTRON-DENSITY MODELS OF MOLECULAR-STRUCTURE
    SHUSTERMAN, GP
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1995, 209 : 487 - CHED
  • [29] MOLECULAR CONNECTIVITY STUDY OF ELECTRON-DENSITY IN ALKANES
    HALL, LH
    KIER, LB
    TETRAHEDRON, 1977, 33 (15) : 1953 - 1957
  • [30] Electron-density studies of molecular magnetic materials
    Pillet, S
    Souhassou, M
    Lecomte, C
    ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2004, 60 : 455 - 464