KFU. Card publication. CGRDB2.0: A PYTHON DATABASE MANAGEMENT SYSTEM FOR MOLECULES, REACTIONS, AND CHEMICAL DATA

KAZAN
FEDERAL UNIVERSITY

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- 中文
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CGRDB2.0: A PYTHON DATABASE MANAGEMENT SYSTEM FOR MOLECULES, REACTIONS, AND CHEMICAL DATA

Form of presentation

Articles in international journals and collections

Year of publication

2022

Authors, employees of KFU

Varnek Aleksandr , author

Madzhidov Timur Ismailovich, author

Nugmanov Ramil Irekovich, author

Other authors

Gimadiev Timur, Sidorov Pavel, Khakimova Aygul

Authors, postgraduates KFU

Fatykhova Adeliya Albertovna, postgraduate kfu

Bibliographic description in the original language

Timur Gimadiev, Ramil Nugmanov, Aigul Khakimova, Adeliya Fatykhova, Timur Madzhidov, Pavel Sidorov, Alexandre Varnek (2021). CGRdb2.0: A Python Database Management System for Molecules, Reactions, and Chemical Data. Journal of Chemical Information and Modeling.

Keywords

molecule, database, reactions, similarity search

The name of the journal

Journal of Chemical Information and Modeling

URL

https://doi.org/10.1021/acs.jcim.1c01105

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

https://repository.kpfu.ru/eng/?p_id=263731&p_lang=2

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	2022-01-01T00:00:00Z	ru_RU
dc.date.available	2022-01-01T00:00:00Z	ru_RU
dc.date.issued	2022	ru_RU
dc.identifier.citation	Timur Gimadiev, Ramil Nugmanov, Aigul Khakimova, Adeliya Fatykhova, Timur Madzhidov, Pavel Sidorov, Alexandre Varnek (2021). CGRdb2.0: A Python Database Management System for Molecules, Reactions, and Chemical Data. Journal of Chemical Information and Modeling.	ru_RU
dc.identifier.uri	https://repository.kpfu.ru/eng/?p_id=263731&p_lang=2	ru_RU
dc.description.abstract	Journal of Chemical Information and Modeling	ru_RU
dc.language.iso	ru	ru_RU
dc.subject	molecule	ru_RU
dc.subject	database	ru_RU
dc.subject	reactions	ru_RU
dc.subject	similarity search	ru_RU
dc.title	CGRDB2.0: A PYTHON DATABASE MANAGEMENT SYSTEM FOR MOLECULES, REACTIONS, AND CHEMICAL DATA	ru_RU
dc.type	Articles in international journals and collections	ru_RU