General discussion

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Topics (1287)
Replies Last Post Views
(no subject) by dong_li3
1
by JP
openbabel comparison ... sp3 stereochemistry by nms_uk
3
by Geoffrey Hutchison
Charged formula by Pascal Muller-3
3
by Andrew Dalke
Isomorphism between cyclo-pentane and pentane by andi
10
by andi
Python Openbabel Module Difficulties by Bradley Calhoun
6
by Noel O'Boyle
Silicos announces the release of STRIPPER v1.0.4 by Hans De Winter
2
by Noel O'Boyle
Printing mol title in error message by Pascal Muller-3
6
by Pascal Muller-3
SMARTS Match Problem by qiancheng shen
2
by qiancheng shen
Problem reading pdbqt files from .dlg (Autodock 4) by David GarcĂ­a Aristeg...
1
by Noel O'Boyle
iBabel update by christopherswain@btc...
0
by christopherswain@btc...
Small regression? by Paolo Tosco
0
by Paolo Tosco
Small regression? by Paolo Tosco
0
by Paolo Tosco
Open Babel documentation available in book format by Noel O'Boyle
0
by Noel O'Boyle
Error while installing openbabel-python bindings on Linux (Cent OS 64) by qiancheng shen
1
by Igor Filippov
problems assigning charges with Babel by tasoares
1
by Geoffrey Hutchison-3
Error - install - linux by Eliac Brown
3
by Noel O'Boyle
Funded project for undergraduate student on forcefield development in Open Babel by Noel O'Boyle
0
by Noel O'Boyle
Asking about SMARTS by NGUYEN Thanh Binh-2
9
by Pascal Muller-3
help - segmentation fault with Pybel on Mac OS x by Hassan Thomas Mamdan...
1
by Geoffrey Hutchison
Report weird behaviour of Tanimoto / readfile with Pybel by Floriane Montanari
4
by Floriane Montanari
mol2 substructure section by Yuri Pevzner
1
by Pascal Muller-3
Re: Very Import by Noel O'Boyle
0
by Noel O'Boyle
Silicos announces the release of ProfiLIB, a free compound library characterization tool by Hans De Winter
0
by Hans De Winter
Silicos announces the release of ProfiLIB, a free compound library characterization tool by Hans De Winter
0
by Hans De Winter
Use of wild card characters in iBabel GUI ? by Felix Grun
1
by christopherswain@btc...
Re: CCL: Problems with adding hydrogens by Geoffrey Hutchison-3
1
by Heribert Reis
obminimize by christopherswain@btc...
2
by christopherswain@btc...
Re: Use of wild card characters in iBabel GUI ? (Felix Grun) by christopherswain@btc...
0
by christopherswain@btc...
obfit -- multiple hits for a given SMARTS in ligand? by Lucas Nivon
1
by Geoffrey Hutchison
Re: Use of wild card characters in iBabel GUI by christopherswain@btc...
0
by christopherswain@btc...
Problems with 'add hydrogen' by Heribert Reis
1
by Pascal Muller-3
List of monatomic ions for all elements... by Ken Smith
1
by Andrew Dalke
bug in car to xyz conversion? by Gabriele Penazzi
2
by Gabriele Penazzi-2
Installation on Solaris by Abhinav Mathur
1
by Geoffrey Hutchison
(no subject) by Jose M. Cabrera-Truj...
4
by Geoffrey Hutchison-3
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