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• • Re: [Open Babel] Fwd: C++ / segfault / "open file" change? Paolo Tosco
  • Re: [Open Babel] Fwd: C++ / segfault / "open file" change? David Hall
  • Re: [Open Babel] Fwd: C++ / segfault / "open file" change? Paolo Tosco
  • Re: [Open Babel] Fwd: C++ / segfault / "open file" change? Martin Kroeker
  • Re: [Open Babel] Fwd: C++ / segfault / "open file" change? Paolo Tosco
• [Open Babel] substructure highlighting via ruby wrapper Dominic Lütjohann
• [Open Babel] Optimization of geometry with the C++ library Nicolas Cheron
  • Re: [Open Babel] Optimization of geometry with the C++ library Noel O'Boyle
  • Re: [Open Babel] Optimization of geometry with the C++ library Nicolas Cheron
• [Open Babel] Nonintegral charge sum Mezei, Mihaly
• [Open Babel] SMARTS charge descriptor Igor Leontyev
• [Open Babel] Spam holdup Geoffrey Hutchison
• [Open Babel] Charges in smarts Igor Leontyev
  • Re: [Open Babel] Charges in smarts Noel O'Boyle
• [Open Babel] OPENBABEL-2.3.2 compiles, passes all tests but shows no plugins Hazard, E. Starr
• [Open Babel] Issues with structures from "-p Add hydrogens appropriate for this pH" davew
• [Open Babel] How to store fingerprints of mols to make it faster similarity calculation | Python 杨弘宾
  • Re: [Open Babel] How to store fingerprints of mols to make it faster similarity calculation | Python Noel O'Boyle
• Re: [Open Babel] obabel: Converting sdf with multi-line properties Jeff Janes
  • Re: [Open Babel] obabel: Converting sdf with multi-line properties Noel O'Boyle
• [Open Babel] Issues with structures from "-p Add hydrogens appropriate for this pH" Dave Wood
• [Open Babel] MMFF94 forcefield phenol atom typing Toby Wright
  • Re: [Open Babel] MMFF94 forcefield phenol atom typing Geoffrey Hutchison
  • Re: [Open Babel] MMFF94 forcefield phenol atom typing Toby Wright
• [Open Babel] Help to conversion format cif_to_pdb Wellisson Gonçalves
  • Re: [Open Babel] Help to conversion format cif_to_pdb Dimitri Maziuk
  • Re: [Open Babel] Help to conversion format cif_to_pdb Wellisson Gonçalves
  • Re: [Open Babel] Help to conversion format cif_to_pdb David Hall
  • Re: [Open Babel] Help to conversion format cif_to_pdb Dimitri Maziuk
  • Re: [Open Babel] Help to conversion format cif_to_pdb Wellisson Gonçalves
  • Re: [Open Babel] Help to conversion format cif_to_pdb Dimitri Maziuk
  • Re: [Open Babel] Help to conversion format cif_to_pdb Wellisson Gonçalves
• [Open Babel] Converting xyz file to a SMILES string in C++ Nicolas Cheron
  • Re: [Open Babel] Converting xyz file to a SMILES string in C++ Noel O'Boyle
  • Re: [Open Babel] Converting xyz file to a SMILES string in C++ Nicolas Cheron
  • [Open Babel] Converting xyz file to a SMILES string in C++ Nicolas Cheron
• [Open Babel] Couting all substructures Nicolas Cheron
  • Re: [Open Babel] Couting all substructures Geoffrey Hutchison
  • [Open Babel] Couting all substructures Nicolas Cheron
  • Re: [Open Babel] Couting all substructures Pascal Muller
  • Re: [Open Babel] Couting all substructures Nicolas Cheron
• [Open Babel] Assign UFF atom types to mol2 file John Doe
• [Open Babel] overlapping atoms of two molecules prasun kumar
• [Open Babel] Problem with the nomenclature of the atoms of the molecule prasun kumar
• [Open Babel] How to get PNG support in OpenBabel/Pybel in Centos? Carolina Román-Salgado
  • Re: [Open Babel] How to get PNG support in OpenBabel/Pybel in Centos? Noel O'Boyle
  • Re: [Open Babel] How to get PNG support in OpenBabel/Pybel in Centos? Carolina Román Salgado
  • Re: [Open Babel] How to get PNG support in OpenBabel/Pybel in Centos? David Hall
  • Re: [Open Babel] How to get PNG support in OpenBabel/Pybel in Centos? Noel O'Boyle
  • Re: [Open Babel] How to get PNG support in OpenBabel/Pybel in Centos? Carolina Román Salgado
  • [Open Babel] How to get PNG support in OpenBabel/Pybel in Centos? Carolina Román-Salgado
• [Open Babel] Bond order in canonical SMILES Lee-Ping Wang
  • Re: [Open Babel] Bond order in canonical SMILES Fredrik Wallner
  • Re: [Open Babel] Bond order in canonical SMILES Craig James
  • Re: [Open Babel] Bond order in canonical SMILES Tim Vandermeersch
• [Open Babel] Make error - Linux 64 bit - GCC 4.6.3 - inchi.dir/all amcates
  • Re: [Open Babel] Make error - Linux 64 bit - GCC 4.6.3 - inchi.dir/all amcates
• [Open Babel] Conformer searching scott_m
  • Re: [Open Babel] Conformer searching Igor Filippov
  • Re: [Open Babel] Conformer searching Scott McKechnie
  • Re: [Open Babel] Conformer searching Igor Filippov
  • Re: [Open Babel] Conformer searching Scott McKechnie
  • Re: [Open Babel] Conformer searching Pascal Muller
  • Re: [Open Babel] Conformer searching Scott McKechnie
• [Open Babel] Java API: Can't use OB anymore due to UnsatisfiedLinkError Joos Kiener
  • Re: [Open Babel] Java API: Can't use OB anymore due to UnsatisfiedLinkError Joos Kiener
  • Re: [Open Babel] Java API: Can't use OB anymore due to UnsatisfiedLinkError Joos Kiener
• [Open Babel] SDF to PDB Daniel Rodriguez Elvira
  • Re: [Open Babel] SDF to PDB Craig James
  • Re: [Open Babel] SDF to PDB Daniel Rodriguez Elvira
  • Re: [Open Babel] SDF to PDB Craig James
• [Open Babel] Question about Conformer Search Torsten Sachse
  • Re: [Open Babel] Question about Conformer Search Geoffrey Hutchison
• Re: [Open Babel] openbabel Geoffrey Hutchison
• [Open Babel] Hi, about install the poltype and python bindings on ubuntu system Peng Wang
  • Re: [Open Babel] Hi, about install the poltype and python bindings on ubuntu system Geoffrey Hutchison
• [Open Babel] OBDotNet Extension Library Bruce Fenske
• [Open Babel] Two smi conversion problems scott_m
  • Re: [Open Babel] Two smi conversion problems Geoffrey Hutchison
  • Re: [Open Babel] Two smi conversion problems Scott McKechnie
  • Re: [Open Babel] Two smi conversion problems Geoffrey Hutchison
  • Re: [Open Babel] Two smi conversion problems Scott McKechnie
• [Open Babel] Helium 0.1 release Tim Vandermeersch
• [Open Babel] File conversion adds unwanted hydrogens Lee-Ping Wang
  • Re: [Open Babel] File conversion adds unwanted hydrogens Tim Vandermeersch
• [Open Babel] Open Babel Shamal A Mehta
  • Re: [Open Babel] Open Babel David Hall
• [Open Babel] Filtering by functional groups question liubo_nashev
  • Re: [Open Babel] Filtering by functional groups question Geoffrey Hutchison
  • Re: [Open Babel] Filtering by functional groups question liubo nashev
• Re: [Open Babel] obgen and other programs Geoffrey Hutchison
• [Open Babel] about silk structure.. Baki Aksakal
  • [Open Babel] calculate faradaic efficiency Bengt
  • Re: [Open Babel] calculate faradaic efficiency Geoffrey Hutchison
  • Re: [Open Babel] calculate faradaic efficiency Bengt
  • Re: [Open Babel] about silk structure.. Geoffrey Hutchison
• [Open Babel] IsHetAtom David Hall
  • Re: [Open Babel] IsHetAtom Geoffrey Hutchison
• [Open Babel] fingerprinting Kayleigh Ougham
  • Re: [Open Babel] fingerprinting Geoffrey Hutchison
• [Open Babel] Doubts regarding random rotor search!! anna
  • Re: [Open Babel] Doubts regarding random rotor search!! Reinis Danne
• [Open Babel] Bug Otto Kohulák
  • Re: [Open Babel] Bug Geoffrey Hutchison
• [Open Babel] Openbabel build failing on Mac OS 9 S Joshua Swamidass
  • Re: [Open Babel] Openbabel build failing on Mac OS Geoffrey Hutchison
• [Open Babel] Python .dll ignored when compiling on Mac OS X Maverick Trevor T
  • Re: [Open Babel] Python .dll ignored when compiling on Mac OS X Maverick Trevor T
• [Open Babel] Indometacin mol2 -> other format = Segmentation fault Pascal Muller
  • Re: [Open Babel] Indometacin mol2 -> other format = Segmentation fault Fredrik Wallner
• [Open Babel] Problem with pybel script starting via PHP on Windows Server 2008 64bit Jacka
  • Re: [Open Babel] Problem with pybel script starting via PHP on Windows Server 2008 64bit Noel O'Boyle
  • Re: [Open Babel] Problem with pybel script starting via PHP on Windows Server 2008 64bit Noel O'Boyle
  • Re: [Open Babel] Problem with pybel script starting via PHP on Windows Server 2008 64bit Jacka
• [Open Babel] Multimolecule canonical SMILES Lee-Ping Wang
  • Re: [Open Babel] Multimolecule canonical SMILES Geoffrey Hutchison
  • Re: [Open Babel] [OpenBabel-Devel] Multimolecule canonical SMILES Craig James
  • Re: [Open Babel] [OpenBabel-Devel] Multimolecule canonical SMILES Geoffrey Hutchison
  • Re: [Open Babel] [OpenBabel-Devel] Multimolecule canonical SMILES Tim Vandermeersch
  • Re: [Open Babel] [OpenBabel-Devel] Multimolecule canonical SMILES Tim Vandermeersch
  • Re: [Open Babel] [OpenBabel-Devel] Multimolecule canonical SMILES Lee-Ping Wang
  • Re: [Open Babel] [OpenBabel-Devel] Multimolecule canonical SMILES Lee-Ping Wang
• [Open Babel] running Open Babel in parallel / distributed mode Francois Berenger
  • Re: [Open Babel] running Open Babel in parallel / distributed mode Igor Filippov
  • Re: [Open Babel] running Open Babel in parallel / distributed mode Maciek Wójcikowski
  • Re: [Open Babel] running Open Babel in parallel / distributed mode Francois Berenger
  • Re: [Open Babel] running Open Babel in parallel / distributed mode Noel O'Boyle
  • Re: [Open Babel] running Open Babel in parallel / distributed mode Francois Berenger
  • Re: [Open Babel] running Open Babel in parallel / distributed mode Maciek Wójcikowski
  • Re: [Open Babel] running Open Babel in parallel / distributed mode Francois Berenger
  • Re: [Open Babel] running Open Babel in parallel / distributed mode David Hall
• [Open Babel] make uninstall target Francois Berenger
  • Re: [Open Babel] make uninstall target Noel O'Boyle
  • Re: [Open Babel] make uninstall target David Hall
• [Open Babel] pytest_kekule (Failed) Francois Berenger
• [Open Babel] Tversky_ref and Tversky_db Francois Berenger
  • Re: [Open Babel] Tversky_ref and Tversky_db Geoffrey Hutchison
• [Open Babel] large-scale similarity search Jörg Kurt Wegner
  • Re: [Open Babel] large-scale similarity search Noel O'Boyle
  • Re: [Open Babel] large-scale similarity search Björn Grüning
• [Open Babel] Are the pqr lines created by Open Babel in fixed format? Francois Berenger
  • Re: [Open Babel] Are the pqr lines created by Open Babel in fixed format? Geoffrey Hutchison
  • Re: [Open Babel] Are the pqr lines created by Open Babel in fixed format? Igor Filippov
  • Re: [Open Babel] Are the pqr lines created by Open Babel in fixed format? Geoffrey Hutchison
  • Re: [Open Babel] Are the pqr lines created by Open Babel in fixed format? Francois Berenger
• [Open Babel] can i delete solvent by open babel？ unwicky
• [Open Babel] PyCharm integration Ernest Murray
  • Re: [Open Babel] PyCharm integration Noel O'Boyle
• [Open Babel] OBReaction in ruby bindings Dominic Lütjohann
  • Re: [Open Babel] OBReaction in ruby bindings Noel O'Boyle
• [Open Babel] Canonicalize and retain pseudo charges/bonds? Rudesh.AZ
• [Open Babel] missing obabel executable when compiling by sources on HPC Vedat Durmaz
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Noel O'Boyle
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Vedat Durmaz
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Geoffrey Hutchison
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Vedat Durmaz
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Dimitri Maziuk
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Vedat Durmaz
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Maciek Wójcikowski
  • Re: [Open Babel] missing obabel executable when compiling by sources on HPC Vedat Durmaz
• [Open Babel] How to use openbabel_java library on linux 강경태
  • Re: [Open Babel] How to use openbabel_java library on linux David Hall
• Re: [Open Babel] wrong RMSD with symmetry Noel O'Boyle
  • Re: [Open Babel] wrong RMSD with symmetry Noel O'Boyle
  • Re: [Open Babel] wrong RMSD with symmetry Igor Leontyev
• [Open Babel] Quantum Espresso pwscf format conversion problem Otto Kohulák
• [Open Babel] Examples of Openbabel fast substructure searching Mark Forster
  • Re: [Open Babel] Examples of Openbabel fast substructure searching Noel O'Boyle
  • Re: [Open Babel] Examples of Openbabel fast substructure searching rathjyoti
  • Re: [Open Babel] Examples of Openbabel fast substructure searching Fredrik Wallner
  • Re: [Open Babel] Examples of Openbabel fast substructure searching Fredrik Wallner
• [Open Babel] drawing coordinates Dimitri Maziuk
  • Re: [Open Babel] drawing coordinates Dimitri Maziuk
• [Open Babel] Pybel on Python3 + Mavericks Patrick Fuller
  • Re: [Open Babel] Pybel on Python3 + Mavericks Geoffrey Hutchison
  • Re: [Open Babel] Pybel on Python3 + Mavericks Noel O'Boyle
  • Re: [Open Babel] Pybel on Python3 + Mavericks Geoffrey Hutchison
  • Re: [Open Babel] Pybel on Python3 + Mavericks Patrick Fuller
  • Re: [Open Babel] Pybel on Python3 + Mavericks Geoffrey Hutchison
  • Re: [Open Babel] Pybel on Python3 + Mavericks Noel O'Boyle
  • Re: [Open Babel] Pybel on Python3 + Mavericks Geoffrey Hutchison
  • Re: [Open Babel] Pybel on Python3 + Mavericks Matt Swain
  • Re: [Open Babel] Pybel on Python3 + Mavericks Noel O'Boyle
  • Re: [Open Babel] Pybel on Python3 + Mavericks Matt Swain
  • Re: [Open Babel] Pybel on Python3 + Mavericks Geoffrey Hutchison
• Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x Geoffrey Hutchison
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x S Joshua Swamidass
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x Geoffrey Hutchison
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x Noel O'Boyle
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x S Joshua Swamidass
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x Geoffrey Hutchison
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x S Joshua Swamidass
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x S Joshua Swamidass
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x David Hall
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x S Joshua Swamidass
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x Dimitri Maziuk
  • Re: [Open Babel] [OpenBabel-scripting] question about pybel for python 3.x Geoffrey Hutchison
• [Open Babel] --nconf problem Mezei, Mihaly
  • Re: [Open Babel] --nconf problem Geoffrey Hutchison
• [Open Babel] Opening available for maintainer of Open Babel Google+ Page Noel O'Boyle

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