MOLECULAR ELECTROSTATIC POTENTIALS FOR CHARACTERIZING DRUG BIOSYSTEM INTERACTIONS

被引:0
|
作者
CARRUPT, PA
ELTAYAR, N
KARLEN, A
TESTA, B
机构
关键词
D O I
暂无
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:638 / 677
页数:40
相关论文
共 50 条
  • [41] Probing intramolecular interactions using molecular electrostatic potentials: changing electron density contours to unveil both attractive and repulsive interactions
    Roos, Goedele
    Murray, Jane S.
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2024, 26 (09) : 7592 - 7601
  • [42] Generalization of the molecular electrostatic potential for the study of molecular interactions
    Orozco, M
    Luque, FJ
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1997, 214 : 67 - COMP
  • [43] THE MOLECULAR ELECTROSTATIC POTENTIAL AND DRUG DESIGN
    PEPE, G
    SIRI, D
    REBOUL, JP
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1992, 88 : 175 - 185
  • [44] Accurate Conformation-Dependent Molecular Electrostatic Potentials for High-Throughput In Silico Drug Discovery
    Puranen, J. Santeri
    Vainio, Mikko J.
    Johnson, Mark S.
    JOURNAL OF COMPUTATIONAL CHEMISTRY, 2010, 31 (08) : 1722 - 1732
  • [45] Long-distance interactions and principles of molecular recognition at various biosystem organization levels
    Namiot V.A.
    Batyanovskii A.V.
    Filatov I.V.
    Tumanyan V.G.
    Esipova N.G.
    Biophysics, 2016, 61 (1) : 47 - 51
  • [46] Leveraging Electrostatic Interactions for Drug Delivery to the Joint
    Kumar, Shreedevi
    Sharma, Blanka
    BIOELECTRICITY, 2020, 2 (02): : 82 - 100
  • [48] Optimal site charge models for molecular electrostatic potentials
    Karamertzanis, PG
    Pantelides, CC
    MOLECULAR SIMULATION, 2004, 30 (07) : 413 - 436
  • [49] MAXIMAL AND MINIMAL CHARACTERISTICS OF MOLECULAR ELECTROSTATIC POTENTIALS - COMMENT
    SILBERBACH, H
    JOURNAL OF CHEMICAL PHYSICS, 1991, 94 (12): : 8638 - 8638
  • [50] Dipole moments and molecular electrostatic potentials from MSINDO
    Karl Jug
    Lars Kunert
    Andreas M. Köster
    Theoretical Chemistry Accounts, 2000, 104 : 417 - 425