Abstract
The MIFs had been applied to a data set of thirty three (33) dioxazole derivatives to generate the 3D-QSAR model at various 3D grid spacing. An excellent cross-validated correlation coefficient q2 (0.903) and conventional correlation coefficient r2 (0.985) were obtained at a 2.0 Å 3D grid spacing, indicating the statistical significance of this class of compounds. The calculated biological activities showed a high degree of agreement with experimental values. Keywords
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CITATION STYLE
Abul Kashem Liton, M., Bhowmick, A. C., & Ashraf Ali, M. (2013). 3D-QSAR MIFs Studies on 3,5-substituted-1,4,2-dioxazoles Derivatives Using Open3DQSAR Tools. Universal Journal of Chemistry, 1(2), 71–76. https://doi.org/10.13189/ujc.2013.010208
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