News list

September 23, 2017

Ramil Nugmanov

Ramil Nugmanov

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 Calix[4]arenes in the stereoisomeric form 1,3-alternate"

Read More

September 22, 2017

Chemoinformatics and Molecular Modeling Laboratory

Ramil Nugmanov

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.

Researches

The following areas are studied in Chemoinformatics and Molecular Modeling Laboratory:

  • using and development ...
Read More

September 22, 2017

Ilseyar Alimova

Ramil Nugmanov

to be

Read More

September 21, 2017

Adelya Khayrullina

Ramil Nugmanov

Master 2015-2017

Read More

September 21, 2017

Marta Glavatskikh

Ramil Nugmanov

PhD student

Read More

September 21, 2017

Ravil Muhametgaleev

Ramil Nugmanov

to be

Read More

September 20, 2017

Сотрудники лаборатории на конференции в Москве

Ramil Nugmanov

Алимова Ильсеяр и Тутубалина Елена приняли участие на ежегодной конференции АИСТ (Анализ Изображений, Сетей и Текстов) в Москве.

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

Ramil Nugmanov

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

Prediction of pre-exponential constants for cycloaddition reactions

Timur Gimadiev

Description

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.

Usage:

-Draw your reaction in dialog window or download MDL RDF file. Click Submit...

Read More

August 31, 2017

3rd Kazan Summer School on Chemoinformatics

Ramil Nugmanov

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