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Information Journal Paper

Title

QSAR Analysis for Some 1, 2-Benzisothiazol-3-one Derivatives as Caspase-3 Inhibitors by Stepwise MLR Method

Pages

  439-448

Abstract

 AbstractCaspase-3 inhibitory activities of some 1, 2-Benzisothiazol-3-one derivatives were modeled by quantitative structure– activity relationship (QSAR) using Stepwise-multiple linear regression (SW-MLR) method. The built model was robust and predictive with correlation coefficient (R2) of 0. 91 and 0. 59 for training and test groups, respectively. The quality of the model was evaluated by leave-one out (LOO) cross validation (LOO correlation coefficient, ( Q2) of 0. 80). The results indicate that the descriptors related to the electronegativity, the atomic masses, the atomic van der Waals volumes and R--CX--R Atom-centered fragments play a more significant role in caspase-3 inhibitory activity.

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    APA: Copy

    HAJIMAHDI, ZAHRA, Safizadeh, Fatemeh, & ZARGHI, AFSHIN. (2016). QSAR Analysis for Some 1, 2-Benzisothiazol-3-one Derivatives as Caspase-3 Inhibitors by Stepwise MLR Method. IRANIAN JOURNAL OF PHARMACEUTICAL RESEARCH (IJPR), 15(2), 439-448. SID. https://sid.ir/paper/288625/en

    Vancouver: Copy

    HAJIMAHDI ZAHRA, Safizadeh Fatemeh, ZARGHI AFSHIN. QSAR Analysis for Some 1, 2-Benzisothiazol-3-one Derivatives as Caspase-3 Inhibitors by Stepwise MLR Method. IRANIAN JOURNAL OF PHARMACEUTICAL RESEARCH (IJPR)[Internet]. 2016;15(2):439-448. Available from: https://sid.ir/paper/288625/en

    IEEE: Copy

    ZAHRA HAJIMAHDI, Fatemeh Safizadeh, and AFSHIN ZARGHI, “QSAR Analysis for Some 1, 2-Benzisothiazol-3-one Derivatives as Caspase-3 Inhibitors by Stepwise MLR Method,” IRANIAN JOURNAL OF PHARMACEUTICAL RESEARCH (IJPR), vol. 15, no. 2, pp. 439–448, 2016, [Online]. Available: https://sid.ir/paper/288625/en

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