KFU. Card publication. On-Line Reaction Database Cartridge with Built-in Condensed Graph of Reaction-Based Search Engine

KAZAN
FEDERAL UNIVERSITY

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ON-LINE REACTION DATABASE CARTRIDGE WITH BUILT-IN CONDENSED GRAPH OF REACTION-BASED SEARCH ENGINE

Form of presentation

Conference proceedings in international journals and collections

Year of publication

2018

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Authors, employees of KFU

Varnek Aleksandr , author

Madzhidov Timur Ismailovich, author

Nugmanov Ramil Irekovich, author

Fatykhova Adeliya Albertovna, author

Bibliographic description in the original language

Nugmanov R. On-Line Reaction Database Cartridge with Built-in Condensed Graph of Reaction-Based Search Engine / R. Nugmanov, A. Fatykhova, T. Madzhidov, A. Varnek // 6th Strasbourg Summer School in Chemoinformatics: Strasbourg, 25 June - 29 June 2018. - Strasbourg, 2018. - P. 62.

Annotation

6th Strasbourg Summer School in Chemoinformatics: Strasbourg, 25 June - 29 June 2018: book of abstracts.

Keywords

Condensed Graph of Reaction, Reaction Similarity Search, Database Cartridge

The name of the journal

6th Strasbourg Summer School in Chemoinformatics: Strasbourg, 25 June - 29 June 2018: book of abstracts.

Please use this ID to quote from or refer to the card

https://repository.kpfu.ru/eng/?p_id=183831&p_lang=2

Resource files

File name	Size (MB)	Format
F_P24_Nugmanov.pdf	0,19	pdf	show / download

Full metadata record

Field DC	Value	Language
dc.contributor.author	Varnek Aleksandr	ru_RU
dc.contributor.author	Madzhidov Timur Ismailovich	ru_RU
dc.contributor.author	Nugmanov Ramil Irekovich	ru_RU
dc.contributor.author	Fatykhova Adeliya Albertovna	ru_RU
dc.date.accessioned	2018-01-01T00:00:00Z	ru_RU
dc.date.available	2018-01-01T00:00:00Z	ru_RU
dc.date.issued	2018	ru_RU
dc.identifier.citation	Nugmanov R. On-Line Reaction Database Cartridge with Built-in Condensed Graph of Reaction-Based Search Engine / R. Nugmanov, A. Fatykhova, T. Madzhidov, A. Varnek // 6th Strasbourg Summer School in Chemoinformatics: Strasbourg, 25 June - 29 June 2018. - Strasbourg, 2018. - P. 62.	ru_RU
dc.identifier.uri	https://repository.kpfu.ru/eng/?p_id=183831&p_lang=2	ru_RU
dc.description.abstract	6th Strasbourg Summer School in Chemoinformatics: Strasbourg, 25 June - 29 June 2018: book of abstracts.	ru_RU
dc.description.abstract	Nowadays, a large volume of data on chemical reactions has accumulated among various research teams around the world. On the other hand, no known commercially available and convenient database cartridge to combine and store this data is designed so far. Thus, our goal was to develop an on-line database of chemical reactions which may provide with free access to information and search, a user-friendly interface for data registration and developers API interface for integration in own projects. To store reactions, we use the representation of reactions as a combination of molecules with a molecule-to-reaction mapping. Storing links to individual molecules instead of storing each molecule for each reaction saves a huge amount of disk space.	ru_RU
dc.language.iso	ru	ru_RU
dc.subject	Condensed Graph of Reaction	ru_RU
dc.subject	Reaction Similarity Search	ru_RU
dc.subject	Database Cartridge	ru_RU
dc.title	On-Line Reaction Database Cartridge with Built-in Condensed Graph of Reaction-Based Search Engine	ru_RU
dc.type	Conference proceedings in international journals and collections	ru_RU