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Prediction of Molecular Properties by Recursive Neural Networks

 

Marketed By :  VDM Verlag Dr. Müller   Sold By :  Kamal Books International  
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Rs. 3,651

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  • Product Description
 

In the past few years, a novel approach in cheminformatics for the Quantitative Structure-Property Relationship (QSPR) analysis of physical, chemical and biological properties of chemical compounds was developed at the University of Pisa. This methodology is based on the direct treatment of molecular structure, without using numerical descriptors, and employs recursive neural networks. In subsequent studies it was successfully used to predict various properties of different classes of compounds. It is a promising tool in the evaluation of existing substances, as well as in the design of new materials. This master thesis focuses on the prediction of the properties of polymers, a problem not easily treatable with traditional methods based on molecular descriptors. The study explores different representational issues and show the accuracy and flexibility of the structure-based QSPR approach.

Product Specifications
SKU :COC13173
AuthorCarlo Giuseppe Bertinetto,Celia Duce and Roberto Solaro
LanguageEnglish
BindingPaperback
Number of Pages116
Publishing Year2010-04-02T00:00:00.000
ISBN978-3639162097
Edition1st
Book TypeChemistry
Country of ManufactureIndia
Product BrandVDM Verlag Dr. Müller
Product Packaging InfoBox
In The Box1 Piece
Product First Available On ClickOnCare.com2015-07-22 00:00:00