ELECTROSTATIC POTENTIALS AS DESCRIPTORS OF MOLECULAR REACTIVITY - ANALYSIS OF SOME CORRECT PREDICTIONS

被引：0
|
作者：
WEINSTEIN, H [1 ]
OSMAN, R [1 ]
TOPIOL, S [1 ]
机构：
[1] CUNY MT SINAI SCH MED,NEW YORK,NY 10029
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 1980年 / 179卷 / MAR期
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
引用
收藏
页码：94 / PHYS
相关论文
共 50 条
  • [1] Different electrostatic descriptors in comparative molecular field analysis: A comparison of molecular electrostatic and Coulomb potentials
    Kroemer, RT
    Hecht, P
    Liedl, KR
    JOURNAL OF COMPUTATIONAL CHEMISTRY, 1996, 17 (11) : 1296 - 1308
  • [2] Different electrostatic descriptors in comparative molecular field analysis: A comparison of molecular electrostatic and coulomb potentials
    Kroemer, Romano T.
    Hecht, Peter
    Liedl, Klaus R.
    John Wiley and Sons Inc., Newark, United States (17):
  • [3] CORRELATIONS BETWEEN MOLECULAR ELECTROSTATIC POTENTIALS AND SOME EXPERIMENTALLY-BASED INDEXES OF REACTIVITY
    MURRAY, JS
    BRINCK, T
    GRICE, ME
    POLITZER, P
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1992, 88 : 29 - 45
  • [4] Solvent effects on molecular reactivity descriptors: some test cases
    Ilaria Ciofini
    Sandrine Hazebroucq
    Laurent Joubert
    Carlo Adamo
    Theoretical Chemistry Accounts, 2004, 111 : 188 - 195
  • [5] Solvent effects on molecular reactivity descriptors: some test cases
    Ciofini, I
    Hazebroucq, S
    Joubert, L
    Adamo, C
    THEORETICAL CHEMISTRY ACCOUNTS, 2004, 111 (2-6) : 188 - 195
  • [6] MOLECULAR ELECTROSTATIC POTENTIALS - NEGATIVE POTENTIALS ASSOCIATED WITH SOME METHYL AND METHYLENE GROUPS
    POLITZER, P
    DAIKER, KC
    CHEMICAL PHYSICS LETTERS, 1975, 34 (02) : 294 - 297
  • [7] Relationships of molecular surface electrostatic potentials to some macroscopic properties
    Murray, JS
    Brinck, T
    Politzer, P
    CHEMICAL PHYSICS, 1996, 204 (2-3) : 289 - 299
  • [8] Correlating the molecular electrostatic potentials of some organic peroxides with their antimalarial activities
    Jefford, CW
    Grigorov, M
    Weber, J
    Lüthi, HP
    Tronchet, JMJ
    JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES, 2000, 40 (02): : 354 - 357
  • [9] Softened electrostatic molecular potentials
    Besalu, Emili
    Carbo-Dorca, Ramon
    JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2013, 39 : 39 - 49
  • [10] APPROXIMATION OF MOLECULAR ELECTROSTATIC POTENTIALS
    KOSTER, AM
    KOLLE, C
    JUG, K
    JOURNAL OF CHEMICAL PHYSICS, 1993, 99 (02): : 1224 - 1229
12345