کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
1179996 | 962818 | 2008 | 4 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
A simple equation for prediction of net heat of combustion of pure chemicals
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موضوعات مرتبط
مهندسی و علوم پایه
شیمی
شیمی آنالیزی یا شیمی تجزیه
پیش نمایش صفحه اول مقاله
![عکس صفحه اول مقاله: A simple equation for prediction of net heat of combustion of pure chemicals A simple equation for prediction of net heat of combustion of pure chemicals](/preview/png/1179996.png)
چکیده انگلیسی
A quantitative structure property relationship (QSPR) study was performed to develop a model for prediction of standard net heat of combustion of pure chemicals. For developing this model, 1714 pure chemicals were used, and for whichever, 1664 molecular descriptors were determined. As a standard tool for subset variable selection, genetic algorithm based multivariate linear regression (GA–MLR) technique was used. The obtained model is a four parameters multi-linear equation that has a squared correlation coefficient of 0.9954 (R2 = 0.9954).
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Chemometrics and Intelligent Laboratory Systems - Volume 91, Issue 2, 15 April 2008, Pages 177–180
Journal: Chemometrics and Intelligent Laboratory Systems - Volume 91, Issue 2, 15 April 2008, Pages 177–180
نویسندگان
Farhad Gharagheizi,