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.
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Topics (3490)
Replies Last Post Views Sub Forum
Problems installing OpenBabel by Bijay Jassal
1
by Fredrik Wallner
General discussion
Is it possible to support numpy arrays in the python module? by Davide Olianas
1
by Noel O'Boyle
General discussion
Adding Hydrogens by Christopher Beeler
2
by Geoff Hutchison
General discussion
Explicit "implicit hydrogen" count and kekulisation now merged by Noel O'Boyle
0
by Noel O'Boyle
openbabel-devel
Appveyor tests by Noel O'Boyle
10
by mwojcikowski
openbabel-devel
install error by Saman Salike
2
by Noel O'Boyle
General discussion
InChI Question by Hendrik Vennekate
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by Noel O'Boyle
General discussion
removing salts changes the structure and add bonds to heterocyclic compounds with nitrogen... by e_vikeved
2
by Noel O'Boyle
General discussion
how to use CMAKE_PREFIX_PATH with openbabel by Davide Olianas
5
by Davide Olianas
General discussion
Analysis on diversified investment of crusher machine Enterprises by sbmcrusher
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by sbmcrusher
General discussion
Errors with compiling open babel by Nelly Lian
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by Fredrik Wallner
General discussion
kerala taxi by keralataxi
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by keralataxi
General discussion
Modify a forcefield by xh s
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by xh s
General discussion
Canonical SMILES with disconnected parts by xh s
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by Noel O'Boyle
General discussion
Error when using compound.draw() in pybel installed by conda - PNG depiction support not found. by 杨弘宾
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by mwojcikowski
General discussion
Fwd: OB writing non-standard atom types? by Douglas Houston
1
by MelissaCoates
General discussion
how to minimize molecular structure energy by AM1 forcefield by Yalda
1
by Noel O'Boyle
openbabel-devel
Calculating Fingerprints by Mehmet Aziz YIRIK
3
by adepterp
General discussion
About pybel module installation by Phuong Do
2
by collegesniper
General discussion
How to run readstring in pybel? by Peng Yu
5
by supplyservice
General discussion
broken link by Alistar Ottochian
2
by shabdaclinic
General discussion
Maximum size of files by Chris Swain
2
by supremepack
General discussion
(no subject) by Marcos Villarreal
10
by Dimitri Maziuk
General discussion
MM3 atom typing by Jan Halborg Jensen
1
by Noel O'Boyle
General discussion
Pybel and pip install problems by Noel O'Boyle
1
by Geoff Hutchison
openbabel-devel
Cannot use readstring() or readfile() by phuongdnp
11
by Noel O'Boyle
General discussion
conversion AddOption doesn't work by xh s
3
by DavidCyryl
General discussion
FYI, Implicit hydrogens and kekulization branch by Noel O'Boyle
2
by Geoff Hutchison
openbabel-devel
having trouble generating .png picture in c++ by xh s
4
by xh s
General discussion
Generate low energy 3D conformer with python by phuongdo
0
by phuongdo
General discussion
GSoC project introduction - C.C. web repository by Nitish Garg
4
by Noel O'Boyle
openbabel-devel
a problem when using openbabel-2.4.1 to get MACCS by Yang, Dong
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by Yang, Dong
General discussion
Re: [OpenBabel-scripting] Help needed with OpenBabel in python3 by Geoff Hutchison
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by Geoff Hutchison
General discussion
Help needed with OpenBabel in python3 by Nitish Garg
0
by Nitish Garg
openbabel-scripting
Problem with gcc5 and above by Nicolas Cheron
7
by Nicolas Cheron
General discussion
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