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Journal of Molecular Graphics & Modelling|November 1, 2019
Prediction on separation factor of chiral arylhydantoin compounds and recognition mechanism between chiral stationary phase and the enantiomersChengcai Luo, Guixiang Hu, Meilan Huang, et al.
Journal of Molecular Graphics & Modelling|November 4, 2019
Adsorption behavior of β-cyclodextrin onto gold nanoparticlesMaria V Slavgorodska, Alexander Kyrychenko
Journal of Molecular Graphics & Modelling|July 8, 2008
Theoretical 14N nuclear quadrupole resonance parameters for sulfa drugs: sulfamerazine and sulfathiazoleMehdi D Esrafili, Hadi Behzadi, Javad Beheshtian, et al.
Journal of Molecular Graphics & Modelling|April 21, 2009
Quantitative structure-activity relationships for a series of inhibitors of cruzain from Trypanosoma cruzi: molecular modeling, CoMFA and CoMSIA studiesGustavo H G Trossini, Rafael V C Guido, Glaucius Oliva, et al.
Journal of Molecular Graphics & Modelling|May 19, 2009
Pharmacophore and docking-based combined in-silico study of KDR inhibitorsF A Pasha, M Muddassar, M M Neaz, et al.
Journal of Molecular Graphics & Modelling|August 12, 2008
Quantum chemical study of the intermediate complex required for iron-mediated reactivity and antimalarial activity of dispiro-1,2,4-trioxolanesDarren J Creek, David K Chalmers, William N Charman, et al.
Journal of Molecular Graphics & Modelling|July 31, 2009
Clustering files of chemical structures using the Székely-Rizzo generalization of Ward's methodThibault Varin, Ronan Bureau, Christoph Mueller, et al.
Journal of Molecular Graphics & Modelling|November 14, 2008
A docking study of L-chicoric acid with HIV-1 integraseEamonn F Healy, Jonathan Sanders, Peter J King, et al.
Journal of Molecular Graphics & Modelling|November 18, 2008
A theoretical approach to the solvation of brassinosteroidsCercis Morera-Boado, Esther Alonso-Becerra, Raúl González-Jonte, et al.
Journal of Molecular Graphics & Modelling|February 14, 2009
Computed NMR shielding increments over unsaturated five-membered ring heterocyclic compounds as a measure of aromaticityNed H Martin, Jimmy E Rowe, Eddie LaReece Pittman
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