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@datagrok/chembl

v1.1.5

Published

Chembl integration, commonly used queries and browser

Downloads

404

Vulnerabilities

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Links

Git

Maintainers

stleonidstleonidspodgrokspodgrokaparamonov_datagrokaparamonov_datagrokskalkinskalkindskatovdskatov

Keywords

Readme

Chembl

Chembl is a package for the Datagrok platform. It showcases the ability to access data from external data bases (Chembl and UniChem) and detect custom semantic types. The package features are not limited to ChEBML database querying. Implementation of RDKit cartridge shows the ability for similarity and substructure searches in the databases. ChEMBL browser and different types of converts for chemical identifiers and notations also available.

Here are the directories of particular interest:

  • connections : directory with connections settings to external DBs
  • queries : directory with SQL data queries

See also: