Quantcast

Open Babel

Open Babel is a cross-platform program and library designed to interconvert between many file formats used all branches of chemistry. Find out more at http://openbabel.org.
1234 ... 91
Topics (3152)
Replies Last Post Views Sub Forum
2015 New style for men women air jordan 11 low bred basketball shoes by cristin8718
0
by cristin8718
General discussion
Partial charge on OSX system by Guoyi Li
1
by Geoff Hutchison
General discussion
Multiple files conversion by AE
5
by Dimitri Maziuk
General discussion
GAFF in Open Babel by Nicolas Cheron
4
by Geoff Hutchison
General discussion
How to test the cone crusher? by aggregatecrushing
0
by aggregatecrushing
openbabel-devel
Filter PDB with COMPND Identifier by Jack Shultz-2
7
by Smithk795
dll-files by Magnus Norrby
0
by Magnus Norrby
General discussion
SVG "3D" depictions and BountySource by Geoff Hutchison
0
by Geoff Hutchison
openbabel-devel
Can't initialize function 'match_substruct'; The second argument is null when to execute match_substruct() function in mychem.0.9.2 by duanbaogen
1
by Fredrik Wallner
General discussion
Re: [openbabel] OBConversion improvements (#191) by David Koes
0
by David Koes
openbabel-devel
Fwd: [openbabel] OBConversion improvements (#191) by Geoffrey Hutchison-3
3
by Noel O'Boyle
openbabel-devel
Does a identical molecule has the same fingerprint when generating fingerprint FP2 from two dataset ? by kwang
4
by kwang
General discussion
SDF to PDB; CONECT issue by John Degenstein
1
by Noel O'Boyle
General discussion
Python Bindings by michael tro
1
by Noel O'Boyle
General discussion
generating SMARTS from mol2 files by Per Jr. Greisen
1
by Stefano Forli
General discussion
Python SWIG interface - Memory Leak in the OBRotor object by Henrique M. Cezar
0
by Henrique M. Cezar
General discussion
openbabel-python-1.8.py27.exe, No Python installation found in the registry by Jean-Marc Nuzillard
1
by Noel O'Boyle
General discussion
regarding obfit and babel by Per Jr. Greisen
0
by Per Jr. Greisen
General discussion
CIF vs mmCIF by Kirill Okhotnikov
1
by Patrick Fuller
openbabel-devel
Re: OpenBabel-discuss Digest, Vol 109, Issue 2 by Yoel
1
by Yoel
General discussion
CUDA experience ? by Pranav
0
by Pranav
General discussion
Necessary steps before minimization by adel
0
by adel
General discussion
Cannot convert file : babel runs indefinitely by Achira Maloo
0
by Achira Maloo
General discussion
perl api by GeoffWoof
8
by GeoffWoof
General discussion
Getting atoms which i can feed to SetTorsion by Pranav
1
by Pranav
General discussion
obabel -L conformer by Eric Smoll
2
by mwojcikowski
General discussion
Not reading CHG from mol file by Ellen Swann
0
by Ellen Swann
General discussion
Fwd: Google Summer of Code by Geoff Hutchison
7
by rwest
openbabel-devel
How to deal with more than one large database for similarity search and substructure search by duanbaogen
4
by duanbaogen
General discussion
Compiling on Cygwin by Landon_J
1
by Noel O'Boyle
General discussion
pybel calcfp() mismatch? by rikb
4
by Noel O'Boyle
General discussion
Identifying functional groups in a molecule using OpenBabel by amprimiriam
5
by amprimiriam
General discussion
compile error of C++ program (listed in the openbabel web site) using the openbabel library by duanbaogen
1
by Noel O'Boyle
General discussion
MOE extensions to SMARTS by Matt Harvey
4
by Matt Harvey
openbabel-devel
pybel calcfp() mismatch? by rikb
0
by rikb
General discussion
1234 ... 91