OpenBabelGUI 2.4.1 freeware

... convert, analyze, search or store datafrom molecular modeling, chemistry, biochemistry, or related areas. ...

Author Sourceforge
Released 2016-10-11
Filesize 23.00 MB
Downloads 361
OS Windows XP, Windows Vista, Windows Vista x64, Windows 7, Windows 7 x64, Windows 8, Windows 8 x64, Windows 10, Windows 10 x64
Installation Instal And Uninstall
Keywords molecular model, chemical toolbox, analyze molecule, chemistry, analyze, analyzer
Users' rating
(4 rating)
OpenBabelGUI - organic chemistry Freeware Download Notice

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OpenBabelGUI freeware - The Latest User Reviews
OpenBabelGUI freeware - The Latest Versions History
2.4.1 Oct 11, 2016 New Release
2.3.0 RC2 Sep 28, 2010 New Release · New support for 3D coordinate generation using the OBBuilder class.
· Note that this code directly supports non-chiral compounds
· Stereochemistry may or may not be supported in this release
· Significantly faster force fields (up to 200x faster) and support for constrained optimization.
· New force fields, including complete UFF, MMFF94, and MMFF94s implementations.
· Monte Carlo conformer search support, including a new obconformer tool.
· Unified framework for plugin classes, including easy-to program file formats, descriptors, filters, force fields, fingerprints, etc.
· A new "descriptor" plugin framework for QSAR descriptors, etc.
· Initial descriptors include hydrogen-bond donors, acceptors, octanol/water partition, topological polar surface area, molar refractivity, molecular weight, InChI, SMARTS, titles, Lipinski Rule of Five, etc.
· A new "filter" plugin framework for selecting molecules by title, molecular weight, etc.

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2.4.1 freeware download

... convert, analyze, or store data from molecular modeling, chemistry, biochemistry, or related areas Features: Ready-to-use ... and other methods Supports molecular modeling, cheminformatics, bioinformatics Organic chemistry, inorganic chemistry, solid-state materials, nuclear chemistry ...