openbabel-discuss  

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• • Re: [Open Babel] Aromatic bonds Don Kelsey
• [Open Babel] Augmented Reality Chris Swain via OpenBabel-discuss
• [Open Babel] Documentation Issue Nathan Jenkins
  • Re: [Open Babel] Documentation Issue Noel O'Boyle
• [Open Babel] Coding guidelines on style, standards, dependencies David Toneian
  • Re: [Open Babel] Coding guidelines on style, standards, dependencies Geoffrey Hutchison
• [Open Babel] convert several out files to hin or mol Mohammad Goodarzi
  • Re: [Open Babel] convert several out files to hin or mol Geoffrey Hutchison
• [Open Babel] Openbabel Installation Takeru Hayashi
• [Open Babel] Openbabel warnings whustudent
• [Open Babel] error in --gen3d and obminimize yalda62
• [Open Babel] No supported formats listed Groner, Rob
  • Re: [Open Babel] No supported formats listed Geoffrey Hutchison
  • Re: [Open Babel] No supported formats listed Groner, Rob
• [Open Babel] How to set occupancy for a protein created from scratch Lukas Pravda
• [Open Babel] Openbabel and Optimize in Pymol Renee Arias
  • Re: [Open Babel] Openbabel and Optimize in Pymol Tayeb Kakeshpour
• [Open Babel] Openbabel Anaconda package Python 3 support Luciano Kagami
  • Re: [Open Babel] Openbabel Anaconda package Python 3 support Geoffrey Hutchison
• [Open Babel] Gen3d not working in .NET Leif Peterson
  • Re: [Open Babel] Gen3d not working in .NET Noel O'Boyle
  • Re: [Open Babel] Gen3d not working in .NET Leif Peterson
• [Open Babel] Confab conformer search for hydrogen Tayeb Kakeshpour
  • Re: [Open Babel] Confab conformer search for hydrogen Geoffrey Hutchison
• [Open Babel] Open a large .rsmi (443 MB) Mirko Hu
  • Re: [Open Babel] Open a large .rsmi (443 MB) Noel O'Boyle
• [Open Babel] Java bindings undefined symbol: _ZTVN9OpenBabel30OBMinimizingRMSDConformerScoreE Vinothkumar Mohanakrishnan
• [Open Babel] .NET: FP2 maplist is zero-based? Leif Peterson
  • Re: [Open Babel] .NET: FP2 maplist is zero-based? Noel O'Boyle
• [Open Babel] Creating a Symmetric Disulfide Containing SMILES string John Michael Bruning
  • Re: [Open Babel] Creating a Symmetric Disulfide Containing SMILES string Benjamin Bucior
  • Re: [Open Babel] Creating a Symmetric Disulfide Containing SMILES string John Michael Bruning
• [Open Babel] Java Bindings Still Not Getting Built Matthew Lardy
  • Re: [Open Babel] Java Bindings Still Not Getting Built Noel O'Boyle
  • Re: [Open Babel] Java Bindings Still Not Getting Built Matthew Lardy
• [Open Babel] Failed Tests and Broken Bindings (OB 2.4.1) Matthew Lardy
• [Open Babel] Installation of Python Binding ubuntu bill2507733
  • Re: [Open Babel] Installation of Python Binding ubuntu Bilal Shaikh
  • Re: [Open Babel] Installation of Python Binding ubuntu Geoffrey Hutchison
  • Re: [Open Babel] Installation of Python Binding ubuntu Noel O'Boyle
• [Open Babel] Issues with a Static Compile of OB 2.4.1 mlardy
• [Open Babel] Issues Maintaining Bond Order Through Conversion Biruk Abreha
  • Re: [Open Babel] Issues Maintaining Bond Order Through Conversion Noel O'Boyle
  • Re: [Open Babel] Issues Maintaining Bond Order Through Conversion Geoffrey Hutchison
  • Re: [Open Babel] Issues Maintaining Bond Order Through Conversion Dmitri Maziuk via OpenBabel-discuss
• [Open Babel] Babel 1.05 on Android Alan Liška
  • Re: [Open Babel] Babel 1.05 on Android Geoffrey Hutchison
  • [Open Babel] OPENBABEL on Android - license request Alan Liška
  • Re: [Open Babel] OPENBABEL on Android - license request Geoffrey Hutchison
• Re: [Open Babel] Trouble converting .sdf files downloaded from PDB website db4
  • Re: [Open Babel] Trouble converting .sdf files downloaded from PDB website Geoffrey Hutchison
• [Open Babel] saving conformer coordinates from --confab Tayeb Kakeshpour
  • Re: [Open Babel] saving conformer coordinates from --confab Geoffrey Hutchison
  • Re: [Open Babel] saving conformer coordinates from --confab Tayeb Kakeshpour
• [Open Babel] H-Bond Donor detection OpenBabel / Pybel Sebastian Salentin
• [Open Babel] Error on installing openbabel-2.4.1 Yang, Chengxi
  • Re: [Open Babel] Error on installing openbabel-2.4.1 Noel O'Boyle
  • Re: [Open Babel] Error on installing openbabel-2.4.1 Noel O'Boyle
• [Open Babel] Open Babel Gasteiger partial charges and the -p option MichaelSmith
  • Re: [Open Babel] Open Babel Gasteiger partial charges and the -p option Geoffrey Hutchison
  • Re: [Open Babel] Open Babel Gasteiger partial charges and the -p option Stefano Forli
• Re: [Open Babel] RESOLVED -- OpenBabel.openbabel_csharpPINVOKE Exception (error) in .NET Noel O'Boyle
• [Open Babel] obfit question John Michael Bruning
  • Re: [Open Babel] obfit question Geoffrey Hutchison
  • Re: [Open Babel] obfit question John Michael Bruning
  • Re: [Open Babel] obfit question Noel O'Boyle
  • Re: [Open Babel] obfit question John Michael Bruning
• [Open Babel] Visual Studio 2015 C# Initialization Exception, .dll's are Obfuscated? Leif Peterson
  • Re: [Open Babel] Visual Studio 2015 C# Initialization Exception, .dll's are Obfuscated? Noel O'Boyle
• [Open Babel] Help Haddadi Kiandokht
  • Re: [Open Babel] Help Jeff Janes
  • [Open Babel] Help David Ricardo Figueroa Blanco
  • Re: [Open Babel] Help Geoffrey Hutchison
• [Open Babel] Getting bond information Julian Kerr
  • Re: [Open Babel] Getting bond information Geoffrey Hutchison
  • Re: [Open Babel] Getting bond information Dimitri Maziuk via OpenBabel-discuss
• [Open Babel] Displaying Titles for .smi to .png conversion John Michael Bruning
  • Re: [Open Babel] Displaying Titles for .smi to .png conversion Geoffrey Hutchison
• [Open Babel] Question about src/forcefielduff.cpp Tang, Dai
• [Open Babel] Problem of installing open-babel locally on Mac Tang, Dai
  • Re: [Open Babel] Problem of installing open-babel locally on Mac Geoffrey Hutchison
• [Open Babel] print UFF parameters Tang, Dai
  • Re: [Open Babel] print UFF parameters Geoffrey Hutchison
• [Open Babel] Openbabel 2.4.1 reading MOL file with radicals failed dfjk-123
  • Re: [Open Babel] Openbabel 2.4.1 reading MOL file with radicals failed Craig James
  • Re: [Open Babel] Openbabel 2.4.1 reading MOL file with radicals failed dfjk-123
  • Re: [Open Babel] Openbabel 2.4.1 reading MOL file with radicals failed Noel O'Boyle
  • Re: [Open Babel] Openbabel 2.4.1 reading MOL file with radicals failed Noel O'Boyle
  • [Open Babel] Openbabel 2.4.1 reading MOL file with radicals failed 张宝花
• [Open Babel] Problem of installation OpenBabel on Cygwin ??????? ?????
• [Open Babel] Openbabel - 2.4.1 - Compilation error for Python Binding Kumar Jha, Pankaj
  • Re: [Open Babel] Openbabel - 2.4.1 - Compilation error for Python Binding Noel O'Boyle
  • Re: [Open Babel] Openbabel - 2.4.1 - Compilation error for Python Binding Kumar Jha, Pankaj
  • Re: [Open Babel] Openbabel - 2.4.1 - Compilation error for Python Binding Kumar Jha, Pankaj
• [Open Babel] how to convert Mohammad Goodarzi
  • Re: [Open Babel] how to convert Geoffrey Hutchison
• [Open Babel] Suppress openbabel warnings in python devw
• Re: [Open Babel] Openbabel - 2.3.2 with gcc 6.3 Compilation error Geoffrey Hutchison
• [Open Babel] Isomorphisms of Stereoisomers Susanne Salzmann
  • Re: [Open Babel] Isomorphisms of Stereoisomers Noel O'Boyle
• [Open Babel] Atoms order in exported PDB denes
  • Re: [Open Babel] Atoms order in exported PDB Noel O'Boyle
  • Re: [Open Babel] Atoms order in exported PDB Noel O'Boyle
  • Re: [Open Babel] Atoms order in exported PDB Geoffrey Hutchison
  • Re: [Open Babel] Atoms order in exported PDB Dénes Türei
  • Re: [Open Babel] Atoms order in exported PDB Noel O'Boyle
• [Open Babel] For some g09 log files pybel.readfile throws StopIteration error spamidig
  • Re: [Open Babel] For some g09 log files pybel.readfile throws StopIteration error David van der Spoel
  • Re: [Open Babel] For some g09 log files pybel.readfile throws StopIteration error Geoffrey Hutchison
  • [Open Babel] For some g09 log files pybel.readfile throws StopIteration error spamidig
  • Re: [Open Babel] For some g09 log files pybel.readfile throws StopIteration error David van der Spoel
  • Re: [Open Babel] For some g09 log files pybel.readfile throws StopIteration error David van der Spoel
• [Open Babel] Hello, I have a question for Openbabel GUI 윤준곤
  • Re: [Open Babel] Hello, I have a question for Openbabel GUI Benjamin Bucior
• [Open Babel] Buidling OpenBabel devel. lib for windows / msys / mingw64 Sébastien Le Roux
  • Re: [Open Babel] Buidling OpenBabel devel. lib for windows / msys / mingw64 Noel O'Boyle
  • Re: [Open Babel] Buidling OpenBabel devel. lib for windows / msys / mingw64 Sébastien Le Roux
  • [Open Babel] Using OpenBabel devel. lib for windows / msys / mingw64 Sébastien Le Roux
  • Re: [Open Babel] Using OpenBabel devel. lib for windows / msys / mingw64 Noel O'Boyle
  • Re: [Open Babel] Using OpenBabel devel. lib for windows / msys / mingw64 Noel O'Boyle
  • Re: [Open Babel] Using OpenBabel devel. lib for windows / msys / mingw64 Sébastien Le Roux
• [Open Babel] Fail to reproduce obabel --gen3d in pybel Xianghai Sheng
  • Re: [Open Babel] Fail to reproduce obabel --gen3d in pybel Xianghai Sheng
  • Re: [Open Babel] Fail to reproduce obabel --gen3d in pybel Stefano Forli
• [Open Babel] Problems importing pybel on Mac Finn Maloney
  • Re: [Open Babel] Problems importing pybel on Mac Geoffrey Hutchison
• [Open Babel] Reading large coordinate files in C++ using Babel Sébastien Le Roux
  • Re: [Open Babel] Reading large coordinate files in C++ using Babel Stefano Forli
  • Re: [Open Babel] Reading large coordinate files in C++ using Babel Geoffrey Hutchison
  • Re: [Open Babel] Reading large coordinate files in C++ using Babel Benjamin Bucior
  • Re: [Open Babel] Reading large coordinate files in C++ using Babel Sébastien Le Roux
• [Open Babel] fastsearch <-> chemfp converter Andrew Dalke
  • Re: [Open Babel] fastsearch <-> chemfp converter Noel O'Boyle
• [Open Babel] Add hydrogen bonding water to molecule CodyA
  • Re: [Open Babel] Add hydrogen bonding water to molecule Noel O'Boyle
• [Open Babel] Reg: Packing openbabel along with my Java application Vinothkumar Mohanakrishnan
  • Re: [Open Babel] Reg: Packing openbabel along with my Java application Noel O'Boyle
• [Open Babel] using Open Babel for virtual library generation Siavoush Dastmalchi via OpenBabel-discuss
  • Re: [Open Babel] using Open Babel for virtual library generation Stefano Forli
  • Re: [Open Babel] using Open Babel for virtual library generation Benjamin Bucior
  • Re: [Open Babel] using Open Babel for virtual library generation Noel O'Boyle
  • Re: [Open Babel] using Open Babel for virtual library generation Chris Swain
  • Re: [Open Babel] using Open Babel for virtual library generation Nicolas Cheron
  • Re: [Open Babel] using Open Babel for virtual library generation Stefano Forli
  • Re: [Open Babel] using Open Babel for virtual library generation Noel O'Boyle
  • Re: [Open Babel] using Open Babel for virtual library generation Stefano Forli
  • Re: [Open Babel] using Open Babel for virtual library generation Noel O'Boyle
  • Re: [Open Babel] using Open Babel for virtual library generation Stefano Forli
• [Open Babel] Error in file conversion Sundar
  • [Open Babel] Fwd: Error in file conversion Sundar
• [Open Babel] Using OBPairData in python Xianghai Sheng
  • Re: [Open Babel] Using OBPairData in python Noel O'Boyle
  • Re: [Open Babel] Using OBPairData in python Xianghai Sheng
• [Open Babel] netcharge of a molecule Sundar
  • Re: [Open Babel] netcharge of a molecule Andrew Dalke
• [Open Babel] Best way to convert pdbqt to pdb Sundar
  • Re: [Open Babel] Best way to convert pdbqt to pdb Geoffrey Hutchison
  • Re: [Open Babel] Best way to convert pdbqt to pdb Gonzalo Nuñez
  • Re: [Open Babel] Best way to convert pdbqt to pdb Sundar
• [Open Babel] Help with generation of atom names in mol2 format Antonio Jesus Banegas Luna
  • Re: [Open Babel] Help with generation of atom names in mol2 format Maciek Wójcikowski
  • Re: [Open Babel] Help with generation of atom names in mol2 format Antonio Jesus Banegas Luna
• [Open Babel] Canonical smiles for cis/trans species murat keçeli
  • Re: [Open Babel] Canonical smiles for cis/trans species Fredrik Wallner
  • Re: [Open Babel] Canonical smiles for cis/trans species murat keçeli
  • Re: [Open Babel] Canonical smiles for cis/trans species Gonzalo Nuñez
  • Re: [Open Babel] Canonical smiles for cis/trans species Gonzalo Nuñez
  • Re: [Open Babel] Canonical smiles for cis/trans species Noel O'Boyle
  • Re: [Open Babel] Canonical smiles for cis/trans species murat keçeli
  • Re: [Open Babel] Canonical smiles for cis/trans species Dimitri Maziuk
  • Re: [Open Babel] Canonical smiles for cis/trans species Gonzalo Nuñez
  • Re: [Open Babel] Canonical smiles for cis/trans species Fredrik Wallner
• [Open Babel] Issue Jose manuel Suarez Sierra
  • Re: [Open Babel] Issue Fredrik Wallner
  • Re: [Open Babel] Issue Fredrik Wallner
  • Re: [Open Babel] Issue Noel O'Boyle
• [Open Babel] Openbabel installation on virtual envirnment jaidev joshi
  • Re: [Open Babel] Openbabel installation on virtual envirnment Noel O'Boyle
  • Re: [Open Babel] Openbabel installation on virtual envirnment Noel O'Boyle
• [Open Babel] Not able to use Pybel Abhishek Gupta
  • Re: [Open Babel] Not able to use Pybel Noel O'Boyle
• [Open Babel] Open Babel Descriptors Andrew Lang
  • Re: [Open Babel] Open Babel Descriptors Noel O'Boyle
• [Open Babel] Just FYI Chris Swain
• [Open Babel] naming of pictures Jiří Vedral
  • Re: [Open Babel] naming of pictures Geoffrey Hutchison
• [Open Babel] Reg: Conformer Search Write Conformers as SDF File Vinothkumar Mohanakrishnan
  • Re: [Open Babel] Reg: Conformer Search Write Conformers as SDF File Noel O'Boyle
  • Re: [Open Babel] Reg: Conformer Search Write Conformers as SDF File Vinothkumar Mohanakrishnan
• [Open Babel] Obabel warning while pdb to sdf conversion Sundar
  • Re: [Open Babel] Obabel warning while pdb to sdf conversion Noel O'Boyle
• [Open Babel] Aromaticity Sundar
  • Re: [Open Babel] Aromaticity Noel O'Boyle
  • Re: [Open Babel] Aromaticity Craig James
  • Re: [Open Babel] Aromaticity Sundar
  • Re: [Open Babel] Aromaticity Noel O'Boyle
• [Open Babel] ORIGINAL Passport, Driving License, (toefliets...@yahoo.com toefl1
• [Open Babel] ORIGINAL Passport, Driving License, ID, TOEFL / IELTS(toefliets...@yahoo.com) toefl1
• [Open Babel] Bioconda Chris Swain
• Re: [Open Babel] Firefly dat output error Geoffrey Hutchison

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