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Topics (1043)
Replies Last Post Views
Reading molecular coordinates in standard orientation by Mohammad Ghahremanpo...
1
by David van der Spoel
Explicit "implicit hydrogen" count and kekulisation now merged by Noel O'Boyle
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by Noel O'Boyle
Appveyor tests by Noel O'Boyle
10
by mwojcikowski
simply Mary Verducci along with by Arielmiranda
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by Arielmiranda
how to minimize molecular structure energy by AM1 forcefield by Yalda
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by Noel O'Boyle
A Have To Understand On Purchasing Quality Soccer Jersey by LINBIOER
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by LINBIOER
Pybel and pip install problems by Noel O'Boyle
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by Geoff Hutchison
FYI, Implicit hydrogens and kekulization branch by Noel O'Boyle
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by Geoff Hutchison
GSoC project introduction - C.C. web repository by Nitish Garg
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by Noel O'Boyle
BEP: Proposal for removal of Kekule and Aromatic Bond Orders by Noel O'Boyle
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by Noel O'Boyle
Moving trackers from SF to GitHub by Noel O'Boyle
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by Noel O'Boyle
API/ABI changes review for OpenBabel by Andrey Ponomarenko
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by Noel O'Boyle
Mailing list change proposal by Noel O'Boyle
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by Geoff Hutchison
Convenience functions by Noel O'Boyle
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by Stefano Forli
Change to SMILES writer for hypervalent atoms by Noel O'Boyle
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by Noel O'Boyle
Proposal to overhaul/replace OBElementTable by Noel O'Boyle
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by Noel O'Boyle
Proposal to remove all duplicated std::string versus const char* methods by Noel O'Boyle
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by Noel O'Boyle
Migrating bugs, features from SourceForge to GitHub by Geoff Hutchison
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by Noel O'Boyle
Race conditions by Noel O'Boyle
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by Noel O'Boyle
OBMol ctor error on OBDotNet by JohniMichels
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by JohniMichels
Replacement of aromatic.txt SMARTS patterns with switch statement by Noel O'Boyle
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by Noel O'Boyle
How to get the list of integers from an ECFP4 fingerprint? by Francois BERENGER-3
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by Francois BERENGER-3
FASTA File by Joshua Barnett
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by Geoff Hutchison
Compiling OpenBabel with gcc and g++ by Mohammad Ghahremanpo...
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by Noel O'Boyle
Re: Question about openbabel ECFP fingerprint by Geoffrey Hutchison-3
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by Geoffrey Hutchison-3
2.4.1 by Geoff Hutchison
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by mwojcikowski
OB API/ABI changes by Noel O'Boyle
14
by Geoff Hutchison
Fwd: InChI Software version 1.05 by Noel O'Boyle
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by Noel O'Boyle
Fwd: Re: Python bindings version by Noel O'Boyle
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by Noel O'Boyle
ANNOUNCE: Open Babel 2.4.0 Released by Geoffrey Hutchison-3
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by Geoffrey Hutchison-3
Release candidates for Windows: GUI and Python by Noel O'Boyle
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by Noel O'Boyle
possibly a bug in smiles format by NakataMaho
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by NakataMaho
Re: possibly a bug: no spin multiplicity in S, K by NakataMaho
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by NakataMaho
Carbon with 5 bonds by Stefano Forli
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by Stefano Forli
Implicit copy constructor by Mohammad Ghahremanpo...
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by Geoff Hutchison
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