Ligand-receptor interactions, computational

TL Tembe, JA McCammon. Ligand-receptor interactions. Comput Chem 8 281-283, 1984. 

Tembe, B. L. McCammon, J. A., Ligand-receptor interactions, Comput. Chem. 1984, 8, 281-283... 

III. COMPUTATIONAL APPROACHES TO MODELING LIGAND-RECEPTOR INTERACTIONS... 

Computational Studies of Ligand-Receptor Interactions in Ionotropic Glutamate Receptors... 

Cover Illustration Figures 2 and 10 from Chapter 1, Computational Studies of Ligand-Receptor Interactions in Ionotropic Glutamate Receptors by Jeremy R. Greenwood and Tommy Liljefors. 

Fuentes, J.A. (2005) Synthesis and structure-activity relationships of a new model of arylpiperazines. 8. Computational simulation of ligand-receptor interaction of 5-HT(lA)R agonists with selectivity over alphal-adrenoceptors. Journal of Medicinal Chemistry, 48, 2548-2558. 

Ligand-receptor interaction is an important initial step in protein function. The structure of ligand-receptor complex profoundly affects the specificity and efficiency of protein action. The molecular docking performs the computational prediction of... 

B. A. Luty, Z. R. Wasserman, P. Stouten, C. N. Hodge, M. Zacharias, and J. A. McCammon, J. Comput. Chem., 16,454 (1995). A Molecular Mechanics/Grid Method for Evaluation of Ligand-Receptor Interactions. 

Miguet L, Zhang Z, Grigorov MG. Computational studies of ligand-receptor interactions in bitter taste receptors. J. Recept. Signal. Transduct. Res. 2006 26 611-630. 

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