September 23, 2017
Senior researcher [Data mining, QSPR, WEB]
Senior lecturer [software engineering, chemoinformatics, data mining, python programming]
PhD in Organic Chemistry, thesis title "Synthesis of precursors of self-organizing receptor systems: amphiphilic derivatives of Calixarenes in the stereoisomeric form 1,3-alternate"Read More
September 22, 2017
Chemoinformatics and Molecular Modeling Laboratory was established in 2014. The main purpose of our laboratory is to use data mining tools and variety of molecular modeling technologies for solving practical problems of chemistry.
The following areas are studied in Chemoinformatics and Molecular Modeling Laboratory:
September 20, 2017
На конференции выступили ведущие ученые в области автоматической обработки текстов и анализа изображений, а так же представили свои доклады компании Яндекс, Одноклассники и другие.
В рамках конференции они представили свою статью "Automated Detection of Adverse Drug Reactions From Social Media Posts With Machine Learning".
Целью дан...Read More
September 20, 2017
Elena Tutubalina is a Senior Researcher at the Chemoinformatics and Molecular Modeling Laboratory at the Kazan Federal University.
She completed her Ph.D. in Computer Science at the Kazan Federal University in 2016. Her Ph.D. examined product reviews to monitor customer opinions and detect information about functional and usability defects and overall user experience.
Her research interests include information extraction, opinion mining, machine learning, neural networks, and chemoinf...Read More
September 09, 2017
The models were constructed using a dataset on reaction rates and their conditions extracted manually from doctoral and habilitation theses issued from the Academician A.I. Konovalov's group. In total, model was built at 1241 entities that contains different reactions in different conditions. As a modeling method was used Support Vector Regression(SVR). Full workflow will be published soon.
-Draw your reaction in dialog window or download MDL RDF file. Click Submit...Read More
August 31, 2017
The Third Kazan Summer School on Chemoinformatics (KSSCI2017) was held in Kazan, Russia, from 5th to 7th July 2017.
The Book of abstracts accepted for presentation in 3rd Kazan Summer School on Chemoinformatics is available under the link.
Every 2 years, Kazan Summer School on Chemoinformatics welcomes young scientists from all over the world for learning basics of chemoinformatics and related dis...Read More