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Proper Citation: RDKit: Open-Source Cheminformatics Software (RRID:SCR_014274)
Description: An open-source cheminformatics and machine-learning toolkit that is useable from Java or Python. It includes a collection of standard cheminformatics functionality for molecule I/O, substructure searching, chemical reactions, coordinate generation (2D or 3D), fingerprinting, etc., as well as a high-performance database cartridge for working with molecules using the PostgreSQL database. Documentation is available on the main website.
Synonyms: RDKit, RDKit Open-Source Cheminformatics and Machine Learning
Resource Type: software toolkit, software resource
Keywords: cheminformatics, machine learning, software toolkit, open source, python, c++, FASEB list
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The NIDDK Information Network (dkNET) serves the needs of basic and clinical investigators by providing seamless access to large pools of data and research resources relevant to the mission of The National Institute of Diabetes Digestive and Kidney Diseases (NIDDK). dkNET is hosted at University of California San Diego, and is supported by NIH NIDDK grant 2U24DK097771-09.
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