DavidKorczynski / openbabel

Open Babel is a chemical toolbox designed to speak the many languages of chemical data.

Home Page:http://openbabel.org/

Geek Repo:Geek Repo

Github PK Tool:Github PK Tool

Open Babel

GitHub release Download Open Babel Travis CI Google Scholar Citations

Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.

  • Ready-to-use programs, and complete programmer's toolkit
  • Read, write and convert over 90 chemical file formats
  • Filter and search molecular files using SMARTS and other methods
  • Generate 2D and 3D coordinates for SMILES, InChI and other formats
  • Supports molecular modeling, cheminformatics, bioinformatics, organic chemistry, inorganic chemistry, solid-state materials, nuclear chemistry...

Open Babel is distributed under the GNU General Public License (GPL). This program is free software; you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation version 2 of the License. Full details can be found in the file "COPYING" which should be included in your distribution.

For more information, check the Open Babel website.

About

Open Babel is a chemical toolbox designed to speak the many languages of chemical data.

http://openbabel.org/

License:GNU General Public License v2.0


Languages

Language:C++ 63.7%Language:C 32.4%Language:Python 2.0%Language:SWIG 0.7%Language:CMake 0.6%Language:HTML 0.2%Language:POV-Ray SDL 0.2%Language:Perl 0.1%Language:PHP 0.1%Language:Shell 0.0%Language:Ruby 0.0%Language:Batchfile 0.0%Language:C# 0.0%Language:R 0.0%Language:XSLT 0.0%Language:Scala 0.0%Language:Java 0.0%