OpenBabelGUI 2.4.1 freeware

... open, collaborative project allowing anyone to convert, analyze, search or store datafrom molecular modeling, chemistry, biochemistry, or related areas. ...

Author Sourceforge
Released 2016-10-11
Filesize 23.00 MB
Downloads 546
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
(7 rating)
OpenBabelGUICADWindows XP, Windows Vista, Windows Vista x64, Windows 7, Windows 7 x64, Windows 8, Windows 8 x64, Windows 10, Windows 10 x64
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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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