1
I Use This!
Very High Activity

Commits : Listings

Analyzed about 5 hours ago. based on code collected 1 day ago.
Oct 23, 2024 — Oct 23, 2025
Commit Message Contributor Files Modified Lines Added Lines Removed Code Location Date
Merge topic 'find-boost-fix' into master More... over 12 years ago
Merge topic 'hdf5-static' into master More... over 12 years ago
Ensure Boost_USE_STATIC_LIBS is set on Windows More... over 12 years ago
Add find_package(HDF5 ...) for static builds. More... over 12 years ago
Add MOPAC input generator. More... over 12 years ago
Add support for literal '1' or '0' in coord. spec. More... over 12 years ago
Fix bug when building dynamic input generator GUI. More... over 12 years ago
Remove dead code in class definition. More... over 12 years ago
Check that scripts are executable before trying to run them. More... over 12 years ago
Add Molecule::perceiveBondsSimple() method
kylelutz
as Kyle Lutz
More... over 12 years ago
Add type metadata to input generator user options. More... over 12 years ago
Add numberOfCores to the input generator settings. More... over 12 years ago
Add gaussian input generator script. More... over 12 years ago
Expose obabel --minimize in the OpenBabel extension. More... over 12 years ago
Merge topic 'fix-editor-lookup-bug' into master More... over 12 years ago
Fix bug in editor atom-type lookup. More... over 12 years ago
Merge topic 'MopacAuxReaderFix' into master More... over 12 years ago
Mark basis set as invalid if no atoms found. More... over 12 years ago
Merge topic 'fix-includes-molequeue' into master More... over 12 years ago
Include directories can be lists, shouldn't be quoted More... over 12 years ago
Merge topic 'openbabel-3d-gen' into master More... over 12 years ago
Always generate 3D coordinates for certain formats More... over 12 years ago
Merge topic 'UpdateSceneOnMoleculeChange' into master More... over 12 years ago
Use a temporary OBProcess for querying read formats. More... over 12 years ago
Add an emitChanged method to QtGui::Molecule. More... over 12 years ago
Update the scene when the molecule changes. More... over 12 years ago
Merge topic '116-OpenBabelFileReader' into master More... over 12 years ago
Add openbabel file reader extension. More... over 12 years ago
Merge topic '111-InputGeneratorFileHandling' into master More... over 12 years ago
Changes necessary to use the render scene More... over 12 years ago