Abstract: The principles of design of information-analytical system (IAS) intended for design of new inorganic compounds are considered. IAS includes the integrated system of databases on properties of inorganic substances and materials, the system of the programs of pattern recognition, the knowledge base and managing program. IAS allows a prediction of inorganic compounds not yet synthesized and estimation of their some properties.

Keywords: information-analytical system, knowledge discovery in databases, design of new inorganic compounds, pattern recognition, computer learning, knowledge base, databases on properties of inorganic substances and materials.

ACM Classification Keywords: J.6 Computer-aided Design, J.2 Computer Applications & Chemistry, H.2.8 Scientific Databases, I.2.6 Analogies, I.2.6 Learning, I.2.4 Knowledge Representation Formalisms and Methods, C.2.5 Internet.

Link:

INFORMATION-ANALYTICAL SYSTEM FOR DESIGN OF NEW INORGANIC COMPOUNDS

Nadezhda Kiselyova, Andrey Stolyarenko, Vladimir Ryazanov, Vadim Podbel’skii

http://www.foibg.com/ijita/vol15/ijita15-4-p06.pdf