Can Empirical Descriptors Reliably Predict Molecular Lipophilicity ? A QSPR Study Investigation
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چکیده
منابع مشابه
Prediction of pesticides chromatographic lipophilicity from the computational molecular descriptors.
Quantitative structure-property relationship models were developed for the prediction of pesticides and some PAH compounds lipophilicity based on a wide set of computational molecular descriptors and a set of experimental chromatographic data. The chromatographic lipophilicity of pesticides has been evaluated by high-performance liquid chromatography (HPLC) using different chemically bonded (C1...
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ژورنال
عنوان ژورنال: International Journal of Engineering Research and Applications
سال: 2017
ISSN: 2248-9622,2248-9622
DOI: 10.9790/9622-0705015056