kegg drug ATC properties

Published: 15-07-2020| Version 1 | DOI: 10.17632/sdb3vytg48.1
Contributor:
Antoni Oliver

Description

Properties of ATC accepted drugs from merging KEGG database and ATC codes in LigandBox repository. 3D structures and SMILES are generated using OpenBabel SW. Molecular descriptors: https://www.nature.com/articles/srep43738 Managing repo: https://github.com/tonibois/KeggDrugVirtualScreening

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https://www.kaggle.com/tonibois/properties-of-atc-accepted-medicines