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3D QSAR Pharmacophore Modeling, in Silico Screening, and Density Functional Theory (DFT) Approaches for Identification of Human Chymase Inhibitors

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International Journal of Molecular Sciences, Vol. 12, Iss. 12, 2011-12 ,pp. : 9236-9264

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One Pot Selective Arylation of 2-Bromo-5-Chloro Thiophene; Molecular Structure Investigation via Density Functional Theory (DFT), X-ray Analysis, and Their Biological Activities

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International Journal of Molecular Sciences, Vol. 17, Iss. 7, 2016-06 ,pp. : 912-912

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Improving the Accuracy of Density Functional Theory (DFT) Calculation for Homolysis Bond Dissociation Energies of Y-NO Bond: Generalized Regression Neural Network Based on Grey Relational Analysis and Principal Component Analysis

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International Journal of Molecular Sciences, Vol. 12, Iss. 4, 2011-04 ,pp. : 2242-2261

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A DFT Study of Pyrrole-Isoxazole Derivatives as Chemosensors for Fluoride Anion

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International Journal of Molecular Sciences, Vol. 13, Iss. 9, 2012-09 ,pp. : 10986-10999

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