This is the Linux app named RDKit whose latest release can be downloaded as RDKit_2016_03_1.win64.py27.zip. It can be run online in the free hosting provider OnWorks for workstations.
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RDKit
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DESCRIPTION
A collection of cheminformatics and machine-learning software written in C++ and Python.
NOTE: the RDKit source code and downloads are now in github: https://github.com/rdkit/rdkit
The core algorithms and data structures are written in C++. Wrappers are provided to use the toolkit from either Python or Java.
Additionally, the RDKit distribution includes a PostgreSQL-based cartridge that allows molecules to be stored in relational database and retrieved via substructure and similarity searches.
Audience
Science/Research, Advanced End Users, Developers
Programming Language
Python, C++, Java
Database Environment
PostgreSQL (pgsql)
Categories
This is an application that can also be fetched from https://sourceforge.net/projects/rdkit/. It has been hosted in OnWorks in order to be run online in an easiest way from one of our free Operative Systems.
