Open Babel

Open Babel is a cross-platform program and library designed to interconvert between many file formats used all branches of chemistry. Find out more at http://openbabel.org.
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Sub-Forums & Topics (959)
Replies Last Post Views
Mychem v0.8.0 by Jérôme Pansanel
0
by Jérôme Pansanel
markush structures in openbabel by Igor Filippov
5
by Chris Morley-3
Processing a multi-conformational sd-file by Hans De Winter
7
by Tim Vandermeersch
openbabel web service by Christian Meisenbich...
17
by Tim Vandermeersch
Release of the R.E.D.-III.4 tools by FyD-2
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by FyD-2
hcounts by Andrew Norgan
1
by Geoffrey Hutchison
Re: Freezing atoms during molecular mechanics by Christopher Wassman
9
by Christopher Wassman
newbie compiling issues by Prashanth Athri
1
by Geoffrey Hutchison
version number in python by Tobias Schmidt
2
by Geoffrey Hutchison
FastSearch class by Rob Soe
0
by Rob Soe
newbie compiling problems by Prashanth Athri-2
0
by Prashanth Athri-2
Static compilation error on windows by Jonathan Dubois-3
1
by Noel O'Boyle
Troubleshooting --filter by mha
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by mha
Multiple 2D drawings from 3D-zmatrix by John McKelvey
1
by Geoffrey Hutchison
Tanimoto (Tc) calculation by Rob Soe
4
by Rob Soe
Need to create publishable 2D drawings from 3D MOPAC file by John McKelvey
1
by Noel O'Boyle
Adding extra information to OBMol by Rob Soe
9
by Noel O'Boyle
Freezing atoms during molecular mechanics by Graham Ball
1
by Tim Vandermeersch
state of OB features by Andrew Dalke
14
by Noel O'Boyle
Issues when using OBProp with Mychem by Jérôme Pansanel
6
by Craig James-2
Freezing atoms during molecular mechanics? by Graham Ball
0
by Graham Ball
MSVCR80.dll error by Kyaw Myint
3
by Noel O'Boyle
how to convert fingerprint into a 01 string by Bing Xiong
2
by Chris Morley-3
Question about parsing a .hin file by horgerj
1
by Chris Morley-3
problem with configuring openbabel-2.0.2 by freya klepsch
1
by Geoffrey Hutchison
-mt;-D_REENTRANT compiling on OpenSolaris by Gleb Sitnikov
1
by Geoffrey Hutchison
TPSA, LogP by Jean-Marc Nuzillard
1
by Noel O'Boyle
Re: some errors during building openbabel dll by Chris Morley-3
1
by Chris Morley-3
installation error by qiaoyan
1
by Geoffrey Hutchison-3
Filter mol2-file by C-atoms by Karl
0
by Karl
fast index search on linux by Andy D P
4
by lirong wang
Two questions: Atom names and auto-calculated charges by Rocco Moretti-2
1
by Geoffrey Hutchison
Building 3D Coordinates in Java with OpenBabel by Leonid Chepelev
6
by Leonid Chepelev
compilation error using icpc by Ryan P. Steele
2
by Noel O'Boyle
where do I find obgrep? by Anke Krause und Andr...
1
by Chris Morley-3
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