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RDKit 2012.03.1

 
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A collection of cheminformatics and machine-learning software written in C++ and Python.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.

Platforms: Linux , Mac , Windows , Mac , Windows 95/98

System requirements: Not specified

 
Added: 27 February, 2013 File size: 10.6 MB
Status: new Download times: 512 kb/s: 02 m 51 s
Program type: freeware   1 Mb/s: 01 m 26 s
      2 Mb/s: 43 s
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