Dmitry Roshchin
4043df49c0
- Update to version 2.10:
* Improvement of the ring statistics algorithm, that can now be
up to twice faster.
* Minor bug correction in the calculation of bond distances
during ring statistics calculations.
* Few minor bug corrections
- Update to version 2.9:
* Minor bug correction for bond angles and dihedral angles
calculation for systems with more than 2 chemical species.
- Update to version 2.8:
* Bug correction in calculation of inter-atomic distances
for non-cubic system when wrapping unwrapped MD trajectory.
- Update to version 2.7:
* Bug correction in calculation of inter-atomic distances
for non-cubic system when wrapping unwrapped MD trajectory.
- Update to version 2.6:
* Bug correction in the calculation of cell parameters for
non-cubic systems that might affects particular cases.
* Improvements here and there.
- Update to version 2.5:
* Major bug correction for the calculation of the dihedral angles
* Minor bugs corrections and improvements of the GUI
- Update to version 2.4:
* Bug correction for the calculation of the MSD
* Minor bugs corrections and improvements of the GUI
- Clean up spec file
OBS-URL: https://build.opensuse.org/request/show/1224619
OBS-URL: https://build.opensuse.org/package/show/science/ISAACS?expand=0&rev=6
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Sun Nov 17 05:28:18 UTC 2024 - Stefan Brüns <stefan.bruens@rwth-aachen.de>
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- Update to version 2.10:
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* Improvement of the ring statistics algorithm, that can now be
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up to twice faster.
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* Minor bug correction in the calculation of bond distances
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during ring statistics calculations.
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* Few minor bug corrections
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- Update to version 2.9:
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* Minor bug correction for bond angles and dihedral angles
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calculation for systems with more than 2 chemical species.
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- Update to version 2.8:
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* Bug correction in calculation of inter-atomic distances
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for non-cubic system when wrapping unwrapped MD trajectory.
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- Update to version 2.7:
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* Bug correction in calculation of inter-atomic distances
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for non-cubic system when wrapping unwrapped MD trajectory.
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- Update to version 2.6:
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* Bug correction in the calculation of cell parameters for
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non-cubic systems that might affects particular cases.
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* Improvements here and there.
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- Update to version 2.5:
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* Major bug correction for the calculation of the dihedral angles
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* Minor bugs corrections and improvements of the GUI
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- Update to version 2.4:
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* Bug correction for the calculation of the MSD
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* Minor bugs corrections and improvements of the GUI
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- Clean up spec file
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-------------------------------------------------------------------
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Sat Jul 7 22:42:17 UTC 2012 - scorot@free.fr
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- spec file reformating
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- use %%configure and %%makeinstall
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-------------------------------------------------------------------
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Sun Feb 26 11:07:47 UTC 2012 - scorot@free.fr
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- remove libgfortran build requirement
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- remove unneeded requirement to silent rpmlint
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- make use %%config for file located in %%{_sysconfigdir}
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- use %%fdupe to remove duplicated file
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- use %%suse_update_desktop_file to manage issac.desktop
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-------------------------------------------------------------------
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Sat Nov 19 13:21:24 UTC 2011 - werner.ho@gmx.de
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- version update 2.3
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