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• 2012/05/24 Re: [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Tim Vandermeersch
• 2012/05/24 [OpenBabel-Devel] [ openbabel-Bugs-3529538 ] SMILES > 32767 characters silently truncated SourceForge . net
• 2012/05/24 [OpenBabel-Devel] [ openbabel-Bugs-3529530 ] Valid SMILES rejected SourceForge . net
• 2012/05/24 Re: [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Geoff Hutchison
• 2012/05/24 Re: [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Craig James
• 2012/05/24 Re: [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Craig James
• 2012/05/24 Re: [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Craig James
• 2012/05/24 Re: [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Noel O'Boyle
• 2012/05/23 Re: [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Craig James
• 2012/05/23 [OpenBabel-Devel] Aromaticity detection recomputed unnecessarily? Craig James
• 2012/05/23 Re: [OpenBabel-Devel] Git migration? Craig James
• 2012/05/23 Re: [OpenBabel-Devel] Git migration? Noel O'Boyle
• 2012/05/22 Re: [OpenBabel-Devel] Git migration? My Th
• 2012/05/22 [OpenBabel-Devel] [ openbabel-Bugs-3528927 ] SMILES parser loses aromaticity of fullerene SourceForge . net
• 2012/05/22 Re: [OpenBabel-Devel] Cis/trans lost from correct SDF? Noel O'Boyle
• 2012/05/21 [OpenBabel-Devel] Cis/trans lost from correct SDF? Craig James
• 2012/05/21 [OpenBabel-Devel] [ openbabel-Bugs-3528614 ] MCDL uninitialized memory error SourceForge . net
• 2012/05/21 [OpenBabel-Devel] [ openbabel-Bugs-3528540 ] Stereo due to isotopes not supported SourceForge . net
• 2012/05/20 Re: [OpenBabel-Devel] Bug in OBCisTransStereo? Craig James
• 2012/05/20 Re: [OpenBabel-Devel] Bug in OBCisTransStereo? Noel O'Boyle
• 2012/05/20 Re: [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Noel O'Boyle
• 2012/05/16 Re: [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Craig James
• 2012/05/15 [OpenBabel-Devel] Bug in OBCisTransStereo? Craig James
• 2012/05/15 Re: [OpenBabel-Devel] reactions and polymers in openbabel Igor Filippov
• 2012/05/15 Re: [OpenBabel-Devel] reactions and polymers in openbabel Chris Morley
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? My Th
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? David Lonie
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? My Th
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? Rajarshi Guha
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? Igor Filippov [Contr]
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? David Lonie
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? Craig James
• 2012/05/15 Re: [OpenBabel-Devel] Git migration? Craig James
• 2012/05/15 [OpenBabel-Devel] [ openbabel-Bugs-3526933 ] Stereo lost at tet N due to N=O marked as sp2 SourceForge . net
• 2012/05/15 [OpenBabel-Devel] [ openbabel-Bugs-3526902 ] Reading some InChI radicals fails SourceForge . net
• 2012/05/15 [OpenBabel-Devel] [ openbabel-Bugs-3526900 ] Chiral centers not always identified SourceForge . net
• 2012/05/15 [OpenBabel-Devel] [ openbabel-Bugs-3526866 ] Incorrect reading number of bonds from V2000 MOL/SDF SourceForge . net
• 2012/05/14 Re: [OpenBabel-Devel] reactions and polymers in openbabel Igor Filippov
• 2012/05/14 Re: [OpenBabel-Devel] Git migration? My Th
• 2012/05/14 Re: [OpenBabel-Devel] Git migration? Igor Filippov [Contr]
• 2012/05/14 Re: [OpenBabel-Devel] Git migration? David Lonie
• 2012/05/14 Re: [OpenBabel-Devel] Git migration? My Th
• 2012/05/14 Re: [OpenBabel-Devel] Git migration? Igor Filippov [Contr]
• 2012/05/14 Re: [OpenBabel-Devel] Git migration? David Lonie
• 2012/05/14 Re: [OpenBabel-Devel] Experimenal branch and project 3.0 My Th
• 2012/05/14 Re: [OpenBabel-Devel] invalid .sdf output from obgen in svn 4747; also wrong chiralities Geoff Hutchison
• 2012/05/14 Re: [OpenBabel-Devel] Experimenal branch and project 3.0 Geoffrey Hutchison
• 2012/05/14 [OpenBabel-Devel] Experimenal branch and project 3.0 My Th
• 2012/05/14 Re: [OpenBabel-Devel] SMILES, rings and implicit cis double bonds Craig James
• 2012/05/14 Re: [OpenBabel-Devel] reactions and polymers in openbabel Igor Filippov
• 2012/05/14 [OpenBabel-Devel] SMILES, rings and implicit cis double bonds Noel O'Boyle
• 2012/05/14 Re: [OpenBabel-Devel] reactions and polymers in openbabel Chris Morley
• 2012/05/14 Re: [OpenBabel-Devel] invalid .sdf output from obgen in svn 4747; also wrong chiralities Noel O'Boyle
• 2012/05/14 Re: [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Noel O'Boyle
• 2012/05/14 Re: [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Noel O'Boyle
• 2012/05/14 [OpenBabel-Devel] [ openbabel-Patches-3526485 ] Silence another set of compiler warnings SourceForge . net
• 2012/05/13 Re: [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Craig James
• 2012/05/13 Re: [OpenBabel-Devel] reactions and polymers in openbabel Chris Morley
• 2012/05/13 [OpenBabel-Devel] Compiler warnings with gcc 4.6 My Th
• 2012/05/13 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 Chris Morley
• 2012/05/13 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 David Lonie
• 2012/05/13 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 Chris Morley
• 2012/05/12 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 David Lonie
• 2012/05/12 [OpenBabel-Devel] [ openbabel-Bugs-3526150 ] genbankformat: Undefined ReadFASTASequence SourceForge . net
• 2012/05/12 [OpenBabel-Devel] [ openbabel-Bugs-3526145 ] Multiple definition of OpenBabel::areDuplicateAtoms SourceForge . net
• 2012/05/12 Re: [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Noel O'Boyle
• 2012/05/12 Re: [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Noel O'Boyle
• 2012/05/12 [OpenBabel-Devel] [ openbabel-Patches-3526035 ] Update for gro format SourceForge . net
• 2012/05/11 [OpenBabel-Devel] Bad bug? Cis/Trans in SMILES dropped in 2.3.x Craig James
• 2012/05/11 [OpenBabel-Devel] xyz coordinates scrambled up newamaichha
• 2012/05/10 Re: [OpenBabel-Devel] change to canon.cpp Craig James
• 2012/05/10 Re: [OpenBabel-Devel] change to canon.cpp Noel O'Boyle
• 2012/05/10 Re: [OpenBabel-Devel] make test - lots of crashes Noel O'Boyle
• 2012/05/09 Re: [OpenBabel-Devel] make test - lots of crashes Craig James
• 2012/05/09 Re: [OpenBabel-Devel] make test - lots of crashes Noel O'Boyle
• 2012/05/09 Re: [OpenBabel-Devel] make test - lots of crashes Geoff Hutchison
• 2012/05/09 [OpenBabel-Devel] make test - lots of crashes Craig James
• 2012/05/09 [OpenBabel-Devel] invalid .sdf output from obgen in svn 4747; also wrong chiralities Thomas Womack
• 2012/05/09 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 Noel O'Boyle
• 2012/05/09 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 David Lonie
• 2012/05/09 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 David Lonie
• 2012/05/09 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 Noel O'Boyle
• 2012/05/08 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 David Lonie
• 2012/05/08 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 Craig James
• 2012/05/08 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 David Lonie
• 2012/05/08 Re: [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 Craig James
• 2012/05/08 [OpenBabel-Devel] Unresolved external: etab on MSVC 2010 David Lonie
• 2012/05/07 Re: [OpenBabel-Devel] Crash on ring iterator Craig James
• 2012/05/07 Re: [OpenBabel-Devel] Crash on ring iterator Craig James
• 2012/05/07 Re: [OpenBabel-Devel] Python bindings now returning long instead of int? Geoffrey Hutchison
• 2012/05/07 Re: [OpenBabel-Devel] Crash on ring iterator Geoffrey Hutchison
• 2012/05/04 Re: [OpenBabel-Devel] Crash on ring iterator Craig James
• 2012/05/04 Re: [OpenBabel-Devel] Crash on ring iterator Igor Filippov
• 2012/05/04 Re: [OpenBabel-Devel] Crash on ring iterator Igor Filippov
• 2012/05/04 [OpenBabel-Devel] Crash on ring iterator Craig James
• 2012/05/04 [OpenBabel-Devel] change to canon.cpp Craig James
• 2012/05/03 [OpenBabel-Devel] C/C++ linker problem? Craig James
• 2012/05/03 Re: [OpenBabel-Devel] reactions and polymers in openbabel Igor Filippov [Contr]
• 2012/05/03 Re: [OpenBabel-Devel] Python bindings now returning long instead of int? Richard West
• 2012/05/03 Re: [OpenBabel-Devel] [Avogadro-devel] OBConformerSearch undefined references, missing vtable Marcus D. Hanwell
• 2012/05/03 Re: [OpenBabel-Devel] OBConformerSearch undefined references, missing vtable Geoff Hutchison
• 2012/05/03 Re: [OpenBabel-Devel] OBConformerSearch undefined references, missing vtable David Lonie
• 2012/05/03 Re: [OpenBabel-Devel] OBConformerSearch undefined references, missing vtable Noel O'Boyle
• 2012/05/03 [OpenBabel-Devel] OBConformerSearch undefined references, missing vtable David Lonie
• 2012/05/02 Re: [OpenBabel-Devel] Python bindings now returning long instead of int? Noel O'Boyle
• 2012/05/01 Re: [OpenBabel-Devel] Python bindings now returning long instead of int? Geoff Hutchison
• 2012/05/01 [OpenBabel-Devel] Python bindings now returning long instead of int? Richard West
• 2012/04/26 [OpenBabel-Devel] [ openbabel-Bugs-3521611 ] Handling two stereobonds at a tet center SourceForge . net
• 2012/04/25 [OpenBabel-Devel] Tautomerization issue Jörg Kurt Wegner
• 2012/04/24 Re: [OpenBabel-Devel] Tautomerization issue Craig James
• 2012/04/24 [OpenBabel-Devel] Tautomerization issue Jörg Kurt Wegner
• 2012/04/18 Re: [OpenBabel-Devel] [Open Babel] problem with aromaticity Noel O'Boyle
• 2012/04/11 Re: [OpenBabel-Devel] Forcefield optimizer tests Geoffrey Hutchison
• 2012/04/11 [OpenBabel-Devel] Forcefield optimizer tests David Lonie
• 2012/04/10 [OpenBabel-Devel] New depictions: ASCII and commands Noel O'Boyle
• 2012/04/10 [OpenBabel-Devel] [ openbabel-Bugs-3516413 ] Some OpenBabel-generated mol files won't be read by RDkit SourceForge . net
• 2012/04/02 [OpenBabel-Devel] [ openbabel-Bugs-3514243 ] Canonical SMILES radicals whose parent molecule is aromatic SourceForge . net
• 2012/04/02 Re: [OpenBabel-Devel] [ openbabel-Bugs-3513220 ] Depiction should render unknown dbl bond stereo Noel O'Boyle
• 2012/03/31 [OpenBabel-Devel] [ openbabel-Bugs-3513745 ] Too large font for "+." symbols SourceForge . net
• 2012/03/30 [OpenBabel-Devel] [ openbabel-Bugs-3513284 ] Canon failure for very simple case of two ions SourceForge . net
• 2012/03/30 [OpenBabel-Devel] [ openbabel-Bugs-3513220 ] Depiction should render unknown dbl bond stereo SourceForge . net
• 2012/03/27 Re: [OpenBabel-Devel] [Avogadro-Discuss] Problem reading a .cif file (Unknown spacegroup) Jean Bréfort
• 2012/03/27 Re: [OpenBabel-Devel] [Avogadro-Discuss] Problem reading a .cif file (Unknown spacegroup) David Lonie
• 2012/03/27 Re: [OpenBabel-Devel] [Avogadro-Discuss] Problem reading a .cif file (Unknown spacegroup) Jean Brefort
• 2012/03/26 [OpenBabel-Devel] [ openbabel-Bugs-3511528 ] Smarts problem SourceForge . net
• 2012/03/20 [OpenBabel-Devel] Bugs and svn log messages Noel O'Boyle
• 2012/03/20 [OpenBabel-Devel] [ openbabel-Feature Requests-3509301 ] Non-zero exit code on error SourceForge . net
• 2012/03/19 [OpenBabel-Devel] [ openbabel-Bugs-3508648 ] Openbabel segmentation fault on a large file SourceForge . net
• 2012/03/15 [OpenBabel-Devel] [ openbabel-Bugs-3505126 ] genalias mishandles the charge separated form of -NO2 SourceForge . net
• 2012/03/15 [OpenBabel-Devel] [ openbabel-Bugs-3505116 ] genalias does not remove hydrogens in the aliased group SourceForge . net
• 2012/03/12 Re: [OpenBabel-Devel] [Avogadro-Discuss] Problem reading a .cif file (Unknown spacegroup) Geoffrey Hutchison
• 2012/03/11 Re: [OpenBabel-Devel] Error in converting Smiles and a crash in FP4 generation Björn Grüning
• 2012/03/11 Re: [OpenBabel-Devel] [Avogadro-Discuss] Problem reading a .cif file (Unknown spacegroup) Jean Bréfort
• 2012/03/11 Re: [OpenBabel-Devel] [Avogadro-Discuss] Problem reading a .cif file (Unknown spacegroup) David Lonie
• 2012/03/10 Re: [OpenBabel-Devel] Error in converting Smiles and a crash in FP4 generation Noel O'Boyle
• 2012/03/10 [OpenBabel-Devel] Error in converting Smiles and a crash in FP4 generation Björn Grüning
• 2012/03/08 Re: [OpenBabel-Devel] License for data files Craig James
• 2012/03/06 [OpenBabel-Devel] [ openbabel-Bugs-3498131 ] Wrong valence for Radicals SourceForge . net
• 2012/03/04 Re: [OpenBabel-Devel] Reading actual CIF atom labels from OBMol N David Brown
• 2012/03/04 Re: [OpenBabel-Devel] Reading actual CIF atom labels from OBMol Vincent Favre-Nicolin
• 2012/03/04 [OpenBabel-Devel] --highlight christophersw...@btconnect.com
• 2012/03/04 Re: [OpenBabel-Devel] Reading actual CIF atom labels from OBMol N David Brown
• 2012/03/04 [OpenBabel-Devel] --highlight Noel O'Boyle
• 2012/03/03 Re: [OpenBabel-Devel] License for data files Geoff Hutchison
• 2012/03/03 Re: [OpenBabel-Devel] License for data files Noel O'Boyle
• 2012/03/03 Re: [OpenBabel-Devel] License for data files Craig James
• 2012/03/03 Re: [OpenBabel-Devel] Playing with SVG Chris Morley
• 2012/03/03 [OpenBabel-Devel] Playing with SVG Noel O'Boyle
• 2012/03/03 [OpenBabel-Devel] License for data files Noel O'Boyle
• 2012/03/01 [OpenBabel-Devel] [ openbabel-Bugs-3496072 ] Smarts and group additivity issue SourceForge . net
• 2012/03/01 [OpenBabel-Devel] [ openbabel-Bugs-3495959 ] Ruby Makefile doesn't generate property SourceForge . net
• 2012/02/28 [OpenBabel-Devel] [ openbabel-Bugs-3495545 ] -ig03 does not handle logfiles with nosym keyword SourceForge . net
• 2012/02/28 Re: [OpenBabel-Devel] Aligning Noel O'Boyle
• 2012/02/27 Re: [OpenBabel-Devel] Aligning Chris Morley
• 2012/02/26 Re: [OpenBabel-Devel] Torsions for MMFF94s Geoffrey Hutchison
• 2012/02/26 [OpenBabel-Devel] Aligning Noel O'Boyle
• 2012/02/26 [OpenBabel-Devel] Torsions for MMFF94s thanasio
• 2012/02/23 Re: [OpenBabel-Devel] What about adding AddNonPolarH, DelPolarH, DelNonPolarH? Paolo Tosco
• 2012/02/23 [OpenBabel-Devel] What about adding AddNonPolarH, DelPolarH, DelNonPolarH? Geoffrey Hutchison
• 2012/02/23 Re: [OpenBabel-Devel] accessing stereochemistry information in Python Noel O'Boyle
• 2012/02/22 Re: [OpenBabel-Devel] Tautomerism Noel O'Boyle
• 2012/02/21 [OpenBabel-Devel] accessing stereochemistry information in Python Gonzalo Hernandez
• 2012/02/21 Re: [OpenBabel-Devel] Tautomerism Tim Vandermeersch
• 2012/02/19 Re: [OpenBabel-Devel] CDX-and chirality(Sept 2007 last post) Danni L Harris
• 2012/02/18 [OpenBabel-Devel] Tautomerism Noel O'Boyle
• 2012/02/17 Re: [OpenBabel-Devel] printing special molecules Chris Morley
• 2012/02/17 [OpenBabel-Devel] printing special molecules kc
• 2012/02/17 [OpenBabel-Devel] Force calculation based question thanasio
• 2012/02/17 Re: [OpenBabel-Devel] Force calculation based question thanasio
• 2012/02/17 Re: [OpenBabel-Devel] CDX-and chirality(Sept 2007 last post) Noel O'Boyle
• 2012/02/16 Re: [OpenBabel-Devel] CDX-and chirality(Sept 2007 last post) Geoff Hutchison
• 2012/02/06 Re: [OpenBabel-Devel] Turbomole Format Reader Questions Ian Kirker
• 2012/02/06 Re: [OpenBabel-Devel] Turbomole Format Reader Questions David Lonie
• 2012/02/05 Re: [OpenBabel-Devel] Turbomole Format Reader Questions Chris Morley
• 2012/02/05 [OpenBabel-Devel] Turbomole Format Reader Questions Ian Kirker
• 2012/01/30 Re: [OpenBabel-Devel] CDash londinium.kitware failing tautomer test Marcus D. Hanwell
• 2012/01/30 [OpenBabel-Devel] [ openbabel-Bugs-3481605 ] Splitting file to generate multiple PNGs doesn't work SourceForge . net
• 2012/01/30 [OpenBabel-Devel] [ openbabel-Bugs-3481603 ] Missing stereo when expanding alias SourceForge . net
• 2012/01/17 Re: [OpenBabel-Devel] Binary serialization of OBMol objects Jérôme Pansanel
• 2012/01/15 Re: [OpenBabel-Devel] CDash londinium.kitware failing tautomer test Geoff Hutchison
• 2012/01/12 [OpenBabel-Devel] CDash londinium.kitware failing tautomer test My Th
• 2012/01/07 Re: [OpenBabel-Devel] Reading actual CIF atom labels from OBMol Vincent Favre-Nicolin
• 2012/01/07 Re: [OpenBabel-Devel] Reading actual CIF atom labels from OBMol N David Brown
• 2012/01/07 Re: [OpenBabel-Devel] Reading actual CIF atom labels from OBMol Vincent Favre-Nicolin
• 2012/01/06 [OpenBabel-Devel] Reading actual CIF atom labels from OBMol N David Brown
• 2012/01/06 [OpenBabel-Devel] [ openbabel-File Format Support-3470246 ] Support for ACDlabs .sk2 file format SourceForge . net
• 2012/01/05 [OpenBabel-Devel] [ openbabel-Bugs-3469904 ] HBA1 descriptor calculation goes crazy, but only sometimes SourceForge . net
• 2012/01/05 Re: [OpenBabel-Devel] Missing ops/opsplit.cpp Chris Morley
• 2012/01/05 [OpenBabel-Devel] Missing ops/opsplit.cpp Geoffrey Hutchison
• 2012/01/05 [OpenBabel-Devel] Splitting multimolecule files Chris Morley
• 2012/01/04 Re: [OpenBabel-Devel] OBFF default line search David Lonie
• 2012/01/04 Re: [OpenBabel-Devel] OBFF default line search Jiahao Chen
• 2012/01/04 [OpenBabel-Devel] mutate residue (contd. from openbabel-discuss) Prashanth Athri
• 2012/01/04 Re: [OpenBabel-Devel] OBFF default line search David Lonie
• 2012/01/04 Re: [OpenBabel-Devel] OBFF default line search Geoffrey Hutchison
• 2012/01/04 Re: [OpenBabel-Devel] OBFF default line search David Lonie
• 2012/01/04 Re: [OpenBabel-Devel] OBFF default line search Noel O'Boyle
• 2012/01/04 [OpenBabel-Devel] OBFF default line search David Lonie
• 2012/01/03 Re: [OpenBabel-Devel] Question about memcpy call in OBForceField::ConjugateGradientsTakeNSteps Geoff Hutchison
• 2012/01/03 Re: [OpenBabel-Devel] Question about memcpy call in OBForceField::ConjugateGradientsTakeNSteps David Lonie

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