دانلود مقالات ISI درباره Quantitative Structure–Property Relationship (Qspr) + ترجمه فارسی

Prediction of boiling points of organic compounds by QSPR tools

Keywords: Normal boiling point; Organic compound; Equilibrium electro-negativity; Molecular descriptor; Quantitative structure-property relationship (QSPR);

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2013 سفارش ترجمه

QSPR study on the viscosity of bis(trifluoromethylsulfonyl)imide-based ionic liquids

Keywords: Ionic liquids; Viscosity; Quantitative structure-property relationship (QSPR);

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2013 سفارش ترجمه

Simple yet accurate prediction method for sublimation enthalpies of organic contaminants using their molecular structure

Keywords: Organic contaminates; Enthalpy of sublimation (HSUB); Gene expression programming (GEP); Quantitative structure-property relationship (QSPR);

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2012 سفارش ترجمه

Prediction of upper flammability limit percent of pure compounds from their molecular structures

Keywords: Upper flammability limit percent; Flame; Quantitative structure-property relationship (QSPR); Genetic algorithm-multivariate linear regression (GA-MLR);

دانلود رایگان متن کامل مقاله ISI 4 صفحه سال انتشار : 2009 سفارش ترجمه

Prediction of the net heat of combustion of organic compounds based on atom-type electrotopological state indices

Keywords: Electrotopological state indices; Organic compounds; Net heat of combustion; Prediction; Quantitative structure-property relationship (QSPR);

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2009 سفارش ترجمه

Prediction of the dielectric dissipation factor tan δ of polymers with an ANN model based on the DFT calculation

Keywords: Artificial neural network; Density functional theory; Dielectric dissipation factor; Polymer; Quantitative structure-property relationship (QSPR);

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2008 سفارش ترجمه

Prediction of auto-ignition temperatures of hydrocarbons by neural network based on atom-type electrotopological-state indices

Keywords: Quantitative structure-property relationship (QSPR); Electrotopological-state indices; Artificial neural network; Auto-ignition temperature; Hydrocarbons;

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2008 سفارش ترجمه

Quantitative structure-property relationship studies for predicting flash points of alkanes using group bond contribution method with back-propagation neural network

Keywords: Quantitative structure-property relationship (QSPR); Back-propagation (BP) neural network; Flash point; Group bond contribution method; Alkane;

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2007 سفارش ترجمه

An investigation of descriptors based on the critical points in the electron density by building quantitative structure-property relationships for proton chemical shifts

Keywords: Atoms in molecules (AIM); Quantitative structure-property relationship (QSPR); Quantitative structure-activity relationship (QSAR); Chemical shift;

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2007 سفارش ترجمه

Estimation of the aqueous solubility (−lgSw) of all polychlorinated dibenzo-furans (PCDF) and polychlorinated dibenzo-p-dioxins (PCDD) congeners by density functional theory

Keywords: Persistent organic pollutants (POPs); Polychlorinated dibenzo-p-dioxins (PCDD); Polychlorinated dibenzo-furans (PCDF); Aqueous solubility (−lgSw); Quantitative structure-property relationship (QSPR); Density functional theory (DFT);

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2006 سفارش ترجمه

Estimation of n-octanol/water partition coefficients (Kow) of all PCB congeners by density functional theory

Keywords: Polychlorinated biphenyls (PCBs); n-Octanol/water partition coefficients (Kow); Persistent organic pollutants (POPs); Quantitative structure-property relationship (QSPR); Density functional theory (DFT);

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2005 سفارش ترجمه