- Oct 30, 2013
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Andreas Schenk authored
fixed lddt compilation on Windows removed DLLEXPORTS from pdbsize.cc
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- Oct 27, 2013
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Marco Biasini authored
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Marco Biasini authored
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Marco Biasini authored
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Marco Biasini authored
A circular dependency caused the gfx.Objects to be retained forever. Breaking the circular dependency solves the problem. As part of the bug-finding process, rewrite large parts of the Scene Window to make it both simpler and saner
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Marco Biasini authored
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- Sep 30, 2013
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BIOPZ-Bertoni Martino authored
temporaly the program is in /import/bc2/home/schwede/bertoni/bin/ialign/bin/ialign.pl
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- Sep 27, 2013
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Bienchen authored
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- Sep 26, 2013
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Marco Biasini authored
While it has been possible to read/write PDb directly from/to arbitrary streams, the stream interface is not exposed to Python yet.
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- Sep 20, 2013
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Andreas Schenk authored
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Gabriel Studer authored
Allows to map the asa and esa values calculated by msms onto the atoms with generic properties using the CalculateSurface function.
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- Aug 25, 2013
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Andreas Schenk authored
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- Aug 23, 2013
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Andreas Schenk authored
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Andreas Schenk authored
Refactored FindEigen.cmake to adhere to cmake guidelines Adapted master CMakeLists.txt to changes in find modules
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Andreas Schenk authored
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Marco Biasini authored
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- Jul 29, 2013
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Marco Biasini authored
The order of destruction of static objects, e.g. singletons is arbitrary and can not be relied upon. For some versions of Python, the singletons are destroyed after Python has shutdown. When objects stored in the singletons have been created in Python, a segfault is produced when they are destroyed, since the destructor assumes a Python interpreter exists. To work around that, we register atexit handlers to remove all references to Python objects. That's required for the IOProfileRegistry and Conopology singletons.
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- Jul 23, 2013
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Niklaus Johner authored
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Niklaus Johner authored
and in Rotation3.SetRotationMatrix(Mat3)
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- Jul 22, 2013
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Niklaus Johner authored
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- Jul 18, 2013
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Ansgar Philippsen authored
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Ansgar Philippsen authored
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- Jul 13, 2013
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Marco Biasini authored
It seems, just looking at the number of atoms is not enough, we also have to look at the hetatm flag. The whole element guessing code is still quite shaky and should be improved.
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Marco Biasini authored
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- Jul 12, 2013
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Bienchen authored
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- Jul 09, 2013
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Andreas Schenk authored
- Fix for data viewer to use main ost menubar: Data viewer menu (labeled Panels) for the active data viewer window will show in the main menu bar. - Added foxus proxy for the data viewer and its QMdiSubwindow to ensure that the data viewer panel gets the keyboard focus from the beginning.
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- Jul 03, 2013
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Tobias Schmidt authored
when adding a gfx entity to the scene using scene.Add(), the time it takes to add it is growing quadratically with the number of entities in the scene (only in gui mode), which is caused by resizing of the table in the sequence viewer.
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- Jun 25, 2013
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Gabriel Studer authored
message
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Gabriel Studer authored
This avoids funny artefacts on tab_old if you create a new table tab_new in the following way and try to add new columns there: tab_new = Table(tab_old.col_names, tab_new.col_types)
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- Jun 24, 2013
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Bienchen authored
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- Jun 19, 2013
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Marco Biasini authored
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Marco Biasini authored
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Marco Biasini authored
this is a follow up to 76b079d7, in which part of the problem, but not the complete one was fixed.
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- Jun 13, 2013
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Andreas Schenk authored
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Bienchen authored
Fixed a glitch in the PDBizer: if more than one set of tranfsormations & chains exist, lingand/ water chains in the entity already exist, but are re-initialsied in a call to PDBizer.Add and added again to the entity... which does not work, of course.
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- Jun 11, 2013
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Valerio Mariani authored
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Valerio Mariani authored
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- Jun 10, 2013
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Valerio Mariani authored
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- Jun 08, 2013
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Valerio Mariani authored
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Valerio Mariani authored
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