Vibeplot, molecular vibrations viewer Activity
Status: Beta
Brought to you by:
mathias_laurin
Activity for Vibeplot, molecular vibrations viewer
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Vibeplot, molecular vibrations viewer released /src/QVibePlot-1.6.0.tar.gz
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Mathias Laurin committed [ba9bd8]
add data/ to gitignore
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Fix axes clearing
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Handle errors and report in loadFile
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Simpler title in save spectrum dialog
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fixup python 2/3
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Add 'Generic Output file format' format
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Reorder import headers
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canonical smiles as title
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mpl toolbar is QToolBar
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Lorentzian broadening by default
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Do not remember path to DB
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Display svg in main window
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Update version to 1.6.0
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fixup rcc rule in Makefile
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Display intensities with frequencies
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Minor UI tweaks
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Handle py2/py3 with six
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Fix printer coroutine
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Change supported formats
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Fixup f634106
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Deep copy molecule to plotters
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Code clean-up
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Update version to 1.5.4
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Fixup f634106
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molden splitter
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Use pybel in QVibePlot
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Split loadData
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Ancestor `Plotter` class
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Update version to 1.5.3
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molden splitter
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Update version to 1.5.3
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Split loadData
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Ancestor `Plotter` class
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Use pybel in QVibePlot
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Update to 0.15.2
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More elegant format choice in open file
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Update version to 0.15.2
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Do not store inefficient OBVibrationData
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remove obsolete code
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Ensure freqs are sorted
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Save image using mpl toolbar
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Set backend with matplotlib.use
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Remove useless code
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Remove obsolete rsc directory
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fixup setup
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Fix license in file
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Update version to 0.15.1
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MplCanvas with sizePolicy Expanding
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fix saveSpectrum
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Fixups to 0.15.1
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Refactor to 0.15.0
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Mathias Laurin committed [3ad69e]
Refactor file parsing.
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Mathias Laurin committed [3170ca]
Oasa library
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Mathias Laurin committed [a88943]
Update version to 0.14.0
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Mathias Laurin committed [5ade26]
Add Orbimol DB to setup.py
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Mathias Laurin committed [b6e60c]
Update version to 0.14.2
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Mathias Laurin committed [cd8ef7]
Remove oasa library added in #3170ca7
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Mathias Laurin committed [8e5668]
Add orbimol database
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Mathias Laurin committed [d4741b]
Add openbabel dlls to setup.py
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Mathias Laurin committed [5f4f2f]
Initial codebase at 0.13
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Mathias Laurin committed [d81388]
Update documentation
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Mathias Laurin committed [54b4d1]
Update documentation.
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Mathias Laurin committed [1b47fe]
Update documentation.
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Mathias Laurin committed [e7e6cc]
Makefile
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Mathias Laurin committed [ada1e0]
Documentation
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Mathias Laurin committed [500bac]
Update version to 0.14.1
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Mathias Laurin committed [b7e09a]
Smarter format guessing
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Mathias Laurin committed [8f4dd6]
Replace own code with openbabel
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Mathias Laurin committed [9aaa5e]
Add support for Orbimol + fixes
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Mathias Laurin committed [ad7de9]
.gitignore
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Mathias Laurin committed [32b94b]
Update documentation.
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