General discussion

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Topics (1202)
Replies Last Post Views
Canonical SMILES with disconnected parts by xh s
5
by Noel O'Boyle
Error when using compound.draw() in pybel installed by conda - PNG depiction support not found. by 杨弘宾
3
by mwojcikowski
Fwd: OB writing non-standard atom types? by Douglas Houston
1
by MelissaCoates
Calculating Fingerprints by Mehmet Aziz YIRIK
3
by adepterp
About pybel module installation by Phuong Do
2
by collegesniper
How to run readstring in pybel? by Peng Yu
5
by supplyservice
broken link by Alistar Ottochian
2
by shabdaclinic
Maximum size of files by Chris Swain
2
by supremepack
(no subject) by Marcos Villarreal
10
by Dimitri Maziuk
MM3 atom typing by Jan Halborg Jensen
1
by Noel O'Boyle
Cannot use readstring() or readfile() by phuongdnp
11
by Noel O'Boyle
conversion AddOption doesn't work by xh s
3
by DavidCyryl
having trouble generating .png picture in c++ by xh s
4
by xh s
Generate low energy 3D conformer with python by phuongdo
0
by phuongdo
a problem when using openbabel-2.4.1 to get MACCS by Yang, Dong
0
by Yang, Dong
Re: [OpenBabel-scripting] Help needed with OpenBabel in python3 by Geoff Hutchison
0
by Geoff Hutchison
Problem with gcc5 and above by Nicolas Cheron
7
by Nicolas Cheron
change charge of a atom in a OBMol by xh s
1
by Noel O'Boyle
In the success of the Blues by anttiraant
0
by anttiraant
Including molecular charge when converting xyz to SMILES by Jan Halborg Jensen
1
by Geoff Hutchison
Calculating fingerprints of a list of SMILES by Mehmet Aziz YIRIK
1
by Andrew Dalke
(no subject) by Tife Awonaike
1
by Noel O'Boyle
Cloud Computing by cloud0029
0
by cloud0029
laundry service by raman0029
0
by raman0029
how to use the new ECFP<n> fingerprints? by Andrew Dalke
5
by Andrew Dalke
GreenLine Trading company by rocky0029
0
by rocky0029
Cashback software by leony0029
0
by leony0029
Does openbabel (python wrapper) affect cairo and ruin it ? by 杨弘宾
1
by Noel O'Boyle
Conformational search by Mohammad Goodarzi
2
by news444
Openbabel to work with optimize command in pymol by Bhattacharjee, Arnab
4
by supremepack
wrong by Jan Halborg Jensen
5
by taxiservices
Positive values of Energy (python) by Filip Stefaniak
2
by homeopathynews
Conversion : CML to SDF by Sebastien
3
by design
error message in the installation test by Cecile Valsecchi
1
by shopping
SMARTS search query by Gravestock David GBJ...
3
by teamouting
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