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• 2015/11/19 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/19 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/19 Re: [Open Babel] Problem in converting a PDB file to MOL2 Dimitri Maziuk
• 2015/11/19 Re: [Open Babel] Problem in converting a PDB file to MOL2 Dimitri Maziuk
• 2015/11/19 Re: [Open Babel] Problem in converting a PDB file to MOL2 Pascal Muller
• 2015/11/19 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/19 Re: [Open Babel] error compiling openbabel Noel O'Boyle
• 2015/11/18 Re: [Open Babel] Problem in converting a PDB file to MOL2 Dimitri Maziuk
• 2015/11/18 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Dimitri Maziuk
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Dimitri Maziuk
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Geoffrey Hutchison
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/17 Re: [Open Babel] Problem in converting a PDB file to MOL2 Pascal Muller
• 2015/11/16 [Open Babel] Problem in converting a PDB file to MOL2 Alexandre Fassio
• 2015/11/16 [Open Babel] error compiling openbabel Osvaldo Martin
• 2015/11/15 [Open Babel] HELP about -k option 张强
• 2015/11/12 Re: [Open Babel] splitting molecule file - the hard case Filip Stefaniak
• 2015/11/10 Re: [Open Babel] splitting molecule file - the hard case Maciek Wójcikowski
• 2015/11/10 Re: [Open Babel] splitting molecule file - the hard case Filip Stefaniak
• 2015/11/10 Re: [Open Babel] splitting molecule file - the hard case Maciek Wójcikowski
• 2015/11/10 [Open Babel] splitting molecule file - the hard case Filip Stefaniak
• 2015/11/09 Re: [Open Babel] why forcefielduff correct angles when calculate energy? Mozzie
• 2015/11/06 [Open Babel] Flagging Potential Aggregators Chris Swain
• 2015/11/06 Re: [Open Babel] why forcefielduff correct angles when calculate energy? Geoffrey Hutchison
• 2015/11/05 [Open Babel] why forcefielduff correct angles when calculate energy? Mozzie
• 2015/11/03 Re: [Open Babel] Fast Search Indexing Not Working Wallace Chan
• 2015/11/03 Re: [Open Babel] Fast Search Indexing Not Working Fredrik Wallner
• 2015/11/02 Re: [Open Babel] Fast Search Indexing Not Working Wallace Chan
• 2015/11/02 [Open Babel] Results from Fastsearch Chris Swain
• 2015/10/30 [Open Babel] use align in pybel Torsten Sachse
• 2015/10/28 Re: [Open Babel] Fast Search Indexing Not Working Noel O'Boyle
• 2015/10/28 [Open Babel] Fast Search Indexing Not Working Wallace Chan
• 2015/10/28 [Open Babel] use align in pybel Yun Ding
• 2015/10/22 Re: [Open Babel] Endless run for a particular SMILES Geoffrey Hutchison
• 2015/10/22 Re: [Open Babel] 'Canonicalizing' Nathan Pimental
• 2015/10/22 Re: [Open Babel] 'Canonicalizing' Andrew Dalke
• 2015/10/22 [Open Babel] 'Canonicalizing' Nathan Pimental
• 2015/10/22 Re: [Open Babel] Generating all-by-all Tanimoto similarity scores in Microsoft GUI Matthew Baumgartner
• 2015/10/22 Re: [Open Babel] Generating all-by-all Tanimoto similarity scores in Microsoft GUI Andrew Dalke
• 2015/10/21 Re: [Open Babel] Generating all-by-all Tanimoto similarity scores in Microsoft GUI Matthew Baumgartner
• 2015/10/21 Re: [Open Babel] Endless run for a particular SMILES Jeff Janes
• 2015/10/21 [Open Babel] 3D sdf file generation fails Kai Bittermann
• 2015/10/21 [Open Babel] Endless run for a particular SMILES Sebastien Moretti
• 2015/10/21 Re: [Open Babel] Generating all-by-all Tanimoto similarity scores in Microsoft GUI seanph16
• 2015/10/20 Re: [Open Babel] Generating all-by-all Tanimoto similarity scores in Microsoft GUI seanph16
• 2015/10/20 Re: [Open Babel] Generating all-by-all Tanimoto similarity scores in Microsoft GUI Noel O'Boyle
• 2015/10/19 [Open Babel] Generating all-by-all Tanimoto similarity scores in Microsoft GUI seanph16
• 2015/10/19 Re: [Open Babel] Error while using OBDotNet dll Pradeep Kumar Verma
• 2015/10/18 Re: [Open Babel] error instaling Torsten Sachse
• 2015/10/17 [Open Babel] error instaling Inês Ferreira
• 2015/10/13 Re: [Open Babel] Error while using OBDotNet dll Charlie M
• 2015/10/12 Re: [Open Babel] Error while using OBDotNet dll Nathan Pimental
• 2015/10/12 Re: [Open Babel] Error while using OBDotNet dll Noel O'Boyle
• 2015/10/11 Re: [Open Babel] Error while using OBDotNet dll Pranav Thakur
• 2015/10/10 [Open Babel] UFF fails to reproduce correct dihedral angle for biphenyl Charlie M
• 2015/10/07 Re: [Open Babel] Error while using OBDotNet dll Vikas Gupta
• 2015/10/05 Re: [Open Babel] Small bug: Single atom xyz to gro results in segmentation fault Torsten Sachse
• 2015/10/03 [Open Babel] Small bug: Single atom xyz to gro results in segmentation fault Eric Smoll
• 2015/09/30 Re: [Open Babel] Error while using OBDotNet dll Pranav Thakur
• 2015/09/30 Re: [Open Babel] Error while using OBDotNet dll Nathan Pimental
• 2015/09/30 [Open Babel] Error while using OBDotNet dll Pranav Thakur
• 2015/09/29 Re: [Open Babel] Determination of partial charges - no difference between force fields? Torsten Sachse
• 2015/09/28 [Open Babel] Pybel descriptors Stefano Forli
• 2015/09/28 Re: [Open Babel] Determination of partial charges - no difference between force fields? Geoffrey Hutchison
• 2015/09/28 Re: [Open Babel] Determination of partial charges - no difference between force fields? Andreas Kempe
• 2015/09/28 [Open Babel] Determination of partial charges - no difference between force fields? Torsten Sachse
• 2015/09/25 Re: [Open Babel] how to copy a ligand into a new OBMol (Yun Ding) Torsten Sachse
• 2015/09/24 Re: [Open Babel] how to copy a ligand into a new OBMol (Yun Ding) Yun Ding
• 2015/09/24 Re: [Open Babel] Regarding Query in ISMILE Pascal Muller
• 2015/09/23 Re: [Open Babel] how to copy a ligand into a new OBMol (Yun Ding) Torsten Sachse
• 2015/09/22 [Open Babel] Regarding Query in ISMILE Vikram Gharge
• 2015/09/22 [Open Babel] how to copy a ligand into a new OBMol Yun Ding
• 2015/09/16 Re: [Open Babel] ligand conformation search Torsten Sachse
• 2015/09/16 Re: [Open Babel] ligand conformation search Geoffrey Hutchison
• 2015/09/15 Re: [Open Babel] ligand conformation search Torsten Sachse
• 2015/09/15 [Open Babel] ligand conformation search Albert
• 2015/09/15 [Open Babel] error in using Convert() function to generate fastsearch index file (C++ code) duanbaogen
• 2015/09/09 Re: [Open Babel] different result between using Tanimoto() function through C++ API and using babel program in command line duanbaogen
• 2015/09/09 Re: [Open Babel] different result between using Tanimoto() function through C++ API and using babel program in command line Jeff Janes
• 2015/09/09 Re: [Open Babel] different result between using Tanimoto() function through C++ API and using babel program in command line Jeff Janes
• 2015/09/09 [Open Babel] different result between using Tanimoto() function through C++ API and using babel program in command line duanbaogen
• 2015/09/08 Re: [Open Babel] multiple structures CIF file Éric Germaneau
• 2015/09/08 [Open Babel] Segmentation fault whenever call function OBRotor::CalcTorsion(coor) Xinqiang Ding
• 2015/09/07 Re: [Open Babel] multiple structures CIF file Torsten Sachse
• 2015/09/06 [Open Babel] Scent Of A Woman People Wall Decals Bogart
• 2015/09/06 [Open Babel] multiple structures CIF file Éric Germaneau
• 2015/09/06 [Open Babel] Elephant Great Day Animal Wall Decals Bogart
• 2015/08/20 Re: [Open Babel] Regarding to installation CHAO-JUNG LIU
• 2015/08/07 Re: [Open Babel] Segmentation fault Geoffrey Hutchison
• 2015/08/06 [Open Babel] Segmentation fault Mezei, Mihaly
• 2015/08/05 Re: [Open Babel] pybel.write() produces truncated pdbqt? (R. K. Belew) R. K. Belew
• 2015/08/05 Re: [Open Babel] pybel.write() produces truncated pdbqt? (R. K. Belew) Torsten Sachse
• 2015/08/04 [Open Babel] Wild Rose Look Like Butterfly Flower Wall Decals Bogart
• 2015/08/04 [Open Babel] I Feel Beautiful Life With Music Modern Wall Decals Bogart
• 2015/08/04 Re: [Open Babel] pybel.write() produces truncated pdbqt? (R. K. Belew) David Hall
• 2015/08/04 Re: [Open Babel] pybel.write() produces truncated pdbqt? (R. K. Belew) R. K. Belew
• 2015/08/04 Re: [Open Babel] pybel.write() produces truncated pdbqt? (R. K. Belew) R. K. Belew
• 2015/08/04 Re: [Open Babel] pybel.write() produces truncated pdbqt? (R. K. Belew) Torsten Sachse
• 2015/08/03 [Open Babel] pybel.write() produces truncated pdbqt? R. K. Belew
• 2015/07/30 Re: [Open Babel] atom types force field Osvaldo Martin
• 2015/07/30 Re: [Open Babel] atom types force field Geoffrey Hutchison
• 2015/07/28 [Open Babel] Blossom Vines and Flying Birds Flower Wall Decals Bogart
• 2015/07/28 [Open Babel] Plane Mini Fly To The Sky Modern Wall Decals Bogart
• 2015/07/15 [Open Babel] HBA1 calculation and L5 filtering in babel program duanbaogen
• 2015/07/15 Re: [Open Babel] [Avogadro-Discuss] Question about CAS numbers Craig James
• 2015/07/15 Re: [Open Babel] [Avogadro-Discuss] Question about CAS numbers Geoffrey Hutchison
• 2015/07/14 Re: [Open Babel] Intramolecular Hydrogen bond detection annndrey
• 2015/07/12 [Open Babel] approved.sdf Fabian Glaser
• 2015/07/10 Re: [Open Babel] Atom types depend on the input file format Nicolas Cheron
• 2015/07/10 [Open Babel] atom types force field Osvaldo Martin
• 2015/07/09 Re: [Open Babel] Atom types depend on the input file format Geoffrey Hutchison
• 2015/07/09 [Open Babel] Atom types depend on the input file format Nicolas Cheron
• 2015/07/07 Re: [Open Babel] Build problems on CentOS cluster Jeff Janes
• 2015/07/07 [Open Babel] Build problems on CentOS cluster Eric Smoll
• 2015/07/06 Re: [Open Babel] Partial charge on OSX system David Hall
• 2015/07/06 Re: [Open Babel] Partial charge on OSX system Geoffrey Hutchison
• 2015/07/06 Re: [Open Babel] dll-files Igor Filippov
• 2015/07/05 Re: [Open Babel] Partial charge on OSX system Geoffrey Hutchison
• 2015/07/05 [Open Babel] Partial charge on OSX system Guoyi Li
• 2015/06/28 Re: [Open Babel] Multiple files conversion Dmitri Maziuk
• 2015/06/27 Re: [Open Babel] Multiple files conversion Craig James
• 2015/06/27 Re: [Open Babel] Multiple files conversion Matthew Baumgartner
• 2015/06/27 [Open Babel] dll-files Magnus Norrby
• 2015/06/27 Re: [Open Babel] Multiple files conversion Dmitri Maziuk
• 2015/06/26 Re: [Open Babel] GAFF in Open Babel Geoffrey Hutchison
• 2015/06/26 Re: [Open Babel] GAFF in Open Babel David van der Spoel
• 2015/06/26 Re: [Open Babel] Multiple files conversion Matthew Baumgartner
• 2015/06/26 [Open Babel] Multiple files conversion AE
• 2015/06/25 Re: [Open Babel] GAFF in Open Babel Nicolas Cheron
• 2015/06/25 Re: [Open Babel] GAFF in Open Babel David van der Spoel
• 2015/06/25 [Open Babel] GAFF in Open Babel Nicolas Cheron
• 2015/06/17 Re: [Open Babel] Can't initialize function 'match_substruct'; The second argument is null when to execute match_substruct() function in mychem.0.9.2 Fredrik Wallner
• 2015/06/16 [Open Babel] Can't initialize function 'match_substruct'; The second argument is null when to execute match_substruct() function in mychem.0.9.2 duanbaogen
• 2015/06/14 Re: [Open Babel] Does a identical molecule has the same fingerprint when generating fingerprint FP2 from two dataset ? kwang
• 2015/06/13 Re: [Open Babel] Does a identical molecule has the same fingerprint when generating fingerprint FP2 from two dataset ? Noel O'Boyle
• 2015/06/12 Re: [Open Babel] Does a identical molecule has the same fingerprint when generating fingerprint FP2 from two dataset ? kwang
• 2015/06/12 Re: [Open Babel] SDF to PDB; CONECT issue Noel O'Boyle
• 2015/06/12 Re: [Open Babel] Does a identical molecule has the same fingerprint when generating fingerprint FP2 from two dataset ? Noel O'Boyle
• 2015/06/11 Re: [Open Babel] Python Bindings Noel O'Boyle
• 2015/06/11 Re: [Open Babel] generating SMARTS from mol2 files Stefano Forli
• 2015/06/11 [Open Babel] Python Bindings michael tro
• 2015/06/11 [Open Babel] Does a identical molecule has the same fingerprint when generating fingerprint FP2 from two dataset ? kwang
• 2015/06/10 [Open Babel] generating SMARTS from mol2 files Per Jr. Greisen
• 2015/06/10 [Open Babel] Python SWIG interface - Memory Leak in the OBRotor object Henrique M. Cezar
• 2015/06/08 [Open Babel] SDF to PDB; CONECT issue John Degenstein
• 2015/06/05 Re: [Open Babel] openbabel-python-1.8.py27.exe, No Python installation found in the registry Noel O'Boyle
• 2015/06/04 [Open Babel] regarding obfit and babel Per Jr. Greisen
• 2015/06/04 [Open Babel] openbabel-python-1.8.py27.exe, No Python installation found in the registry Jean-Marc Nuzillard
• 2015/06/03 Re: [Open Babel] OpenBabel-discuss Digest, Vol 109, Issue 2 Yoel
• 2015/06/03 Re: [Open Babel] OpenBabel-discuss Digest, Vol 109, Issue 2 Yoel
• 2015/06/03 [Open Babel] Cannot convert file : babel runs indefinitely Achira Maloo
• 2015/06/03 [Open Babel] CUDA experience ? Pranav
• 2015/06/03 [Open Babel] Necessary steps before minimization Адель Хафизова
• 2015/05/31 [Open Babel] Not reading CHG from mol file Ellen Swann
• 2015/05/29 [Open Babel] Fwd: perl api Geoffrey Wood
• 2015/05/29 [Open Babel] Fwd: perl api Geoffrey Wood
• 2015/05/29 Re: [Open Babel] Getting atoms which i can feed to SetTorsion Pranav
• 2015/05/29 Re: [Open Babel] obabel -L conformer Maciek Wójcikowski
• 2015/05/29 Re: [Open Babel] obabel -L conformer Pascal Muller
• 2015/05/28 [Open Babel] obabel -L conformer Eric Smoll
• 2015/05/28 [Open Babel] Getting atoms which i can feed to SetTorsion Pranav
• 2015/05/28 Re: [Open Babel] perl api Geoffrey Wood
• 2015/05/28 Re: [Open Babel] perl api Noel O'Boyle
• 2015/05/28 [Open Babel] Fwd: perl api Noel O'Boyle
• 2015/05/28 Re: [Open Babel] perl api Noel O'Boyle
• 2015/05/27 Re: [Open Babel] perl api Geoffrey Wood
• 2015/05/21 Re: [Open Babel] How to deal with more than one large database for similarity search and substructure search duanbaogen
• 2015/05/21 Re: [Open Babel] How to deal with more than one large database for similarity search and substructure search duanbaogen
• 2015/05/21 Re: [Open Babel] How to deal with more than one large database for similarity search and substructure search Jeff Janes
• 2015/05/21 Re: [Open Babel] How to deal with more than one large database for similarity search and substructure search Pascal Muller
• 2015/05/20 [Open Babel] How to deal with more than one large database for similarity search and substructure search duanbaogen
• 2015/05/20 Re: [Open Babel] Compiling on Cygwin Noel O'Boyle
• 2015/05/19 [Open Babel] Compiling on Cygwin Landon_J
• 2015/05/17 Re: [Open Babel] pybel calcfp() mismatch? Noel O'Boyle
• 2015/05/16 Re: [Open Babel] pybel calcfp() mismatch? Andrew Dalke
• 2015/05/15 Re: [Open Babel] pybel calcfp() mismatch? rikb
• 2015/05/15 Re: [Open Babel] Identifying functional groups in a molecule using OpenBabel amprimiriam
• 2015/05/15 Re: [Open Babel] pybel calcfp() mismatch? Andrew Dalke
• 2015/05/14 [Open Babel] pybel calcfp() mismatch? R. K. Belew
• 2015/05/14 Re: [Open Babel] compile error of C++ program (listed in the openbabel web site) using the openbabel library Noel O'Boyle
• 2015/05/14 [Open Babel] compile error of C++ program (listed in the openbabel web site) using the openbabel library duanbaogen
• 2015/05/13 Re: [Open Babel] Identifying functional groups in a molecule using OpenBabel Noel O'Boyle
• 2015/05/13 Re: [Open Babel] Identifying functional groups in a molecule using OpenBabel Pascal Muller
• 2015/05/12 Re: [Open Babel] Identifying functional groups in a molecule using OpenBabel amprimiriam
• 2015/05/09 Re: [Open Babel] Identifying functional groups in a molecule using OpenBabel Noel O'Boyle
• 2015/05/09 [Open Babel] Identifying functional groups in a molecule using OpenBabel amprimiriam
• 2015/05/04 Re: [Open Babel] perl api Geoffrey Hutchison
• 2015/05/04 [Open Babel] perl api Geoffrey Wood
• 2015/04/30 Re: [Open Babel] access all properties from mol2 file Maciek Wójcikowski
• 2015/04/30 Re: [Open Babel] access all properties from mol2 file Hitesh Patel
• 2015/04/30 Re: [Open Babel] access all properties from mol2 file Maciek Wójcikowski
• 2015/04/30 [Open Babel] access all properties from mol2 file Hitesh Patel
• 2015/04/29 Re: [Open Babel] SegFault while adding hydrogens (Python) Noel O'Boyle
• 2015/04/28 Re: [Open Babel] SegFault while adding hydrogens (Python) Dimitri Maziuk
• 2015/04/28 Re: [Open Babel] SegFault while adding hydrogens (Python) Stefano Forli

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