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- Introduction of chemometrics, i.e., mathematical, statistical and computational methods for solving chemical problems, into the applicative, research, and control laboratories
- Modelling of chemical properties and processes in the field of QSAR (Quantitative Structure Activity Relationship) and of data acquired from the hyphenated analytical techniques
- Application of artificial neural network methods in chemistry, study of various ANN learning techniques and development of the corresponding computer software
- Research in the field of mathematical chemistry: the application of discrete mathematics in structural chemistry, in QSAR studies, in proteomics and genomics
- Study of various algorithms and development of computer software - Application of chemometric methods in analytical chemistry for quality control and quality assurance (QA/QC)
- Research of 3D structural structure representations for QSAR
- Education in chemometrics in collaboration with the Faculty of Chemistry and Chemical Technology, University of Ljubljana, Slovenia, on the pre- and postgraduate levels
- Education in the form of special courses in the collaboration with the Faculty of Chemistry and Chemical Technology, University of Maribor, Slovenia
- Education and knowledge transfer between research groups in several countries on the basis of EU projects within Marie Curie training networks
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