[ase-users] Python 2+3 compatible ase-gui

Jens Jørgen Mortensen jensj at fysik.dtu.dk
Thu Jan 12 12:55:11 CET 2017


On 01/12/2017 11:55 AM, Ask Hjorth Larsen wrote:
> Hi
>
> Quitting ase-gui while an animation is playing will not end the
> program, and Ctrl+C in the terminal won't either.  It requires
> manually killing the process.  Affects python2 and 3.

Should be fixed now.

Gaël: Does this also fix your play-stop issue?

Jens Jørgen

>
> Best regards
> Ask
>
> 2017-01-12 10:16 GMT+01:00 Ask Hjorth Larsen <asklarsen at gmail.com>:
>> Hi
>>
>> 2017-01-12 10:07 GMT+01:00 Jens Jørgen Mortensen via ase-users
>> <ase-users at listserv.fysik.dtu.dk>:
>>> On 01/11/2017 12:05 PM, Michael Walter wrote:
>>>> Dear Jens Jorgen,
>>>>
>>>> first of all thanks for your effort and the huge amount of work (I
>>>> imagine) for porting.
>>>>
>>>> It's easy to complain of course, and I apologize that I have to do it.
>>>> Nevertheless, as you asked for it:
>>>>
>>>> Major points:
>>>>
>>>> 1. I, personally, extensively use the coloring possibility and this is
>>>> mainly gone now.
>>>> 2. The setup possibilities of bulk, surface and graphene were very useful
>>>> also.
>>>
>>> Yes, those would be good to have back, but that was the point where I ran
>>> out of energy.  I can finish those later if no one else does it before me,
>>> but I'm not going to hold back 3.13 for that.  I need Python 3 support right
>>> now.
>> What time frame are we talking about (days, weeks, ...)?
>>
>> Best regards
>> Ask
>>
>>> Jens Jørgen
>>>
>>>> Minor points:
>>>>
>>>> 1. In my taste, the structures look more ugly now than before. The black
>>>> lines around the atom-balls are too thin and the bonds too thick.
>>>> 2. The forces are not arrows anymore, but sticks.
>>>>
>>>> I do not think that this should be part of a new release yet. We should
>>>> rather keep old version until we have ported everything from there.
>>>>
>>>> How about keeping both and let the new version evolve ?
>>>>
>>>> Best,
>>>> Michael
>>>>
>>>> 2017-01-11 11:36 GMT+01:00 Jens Jørgen Mortensen via ase-users
>>>> <ase-users at listserv.fysik.dtu.dk <mailto:ase-users at listserv.fysik.dtu.dk>>:
>>>>
>>>>      Hi!
>>>>
>>>>      I have finally managed to port ase-gui to Python 3.  I'd like some
>>>>      feedback before we make an ase-3.13 release.
>>>>
>>>>      It's a slightly trimmed down version of ase-gui with some
>>>>      features/functionality removed.  So, if you feel something
>>>>      important is missing, then please let me know.
>>>>
>>>>      Install the development version and then give it a try. Please try
>>>>      with both Python 2 and 3.  You can do that like this:
>>>>
>>>>          $ python2 -m ase.gui ...
>>>>          $ python3 -m ase.gui ...
>>>>
>>>>      Make sure that you are actually testing the new GUI:  Click Help
>>>>      -> About, and you should see "ASE-GUI (work in progress)".
>>>>
>>>>      You can clone the code or download a development-snapshot as
>>>>      described here:
>>>>
>>>>      https://wiki.fysik.dtu.dk/ase/install.html#installation-from-source
>>>>      <https://wiki.fysik.dtu.dk/ase/install.html#installation-from-source>
>>>>
>>>>      or get it from PyPI:
>>>>
>>>>          $ pip install ase==3.13.0b1 --user
>>>>          $ pip3 install ase==3.13.0b1 --user
>>>>
>>>>      Please report any bugs you find.
>>>>
>>>>      Jens Jørgen
>>>>
>>>>      _______________________________________________
>>>>      ase-users mailing list
>>>>      ase-users at listserv.fysik.dtu.dk
>>>>      <mailto:ase-users at listserv.fysik.dtu.dk>
>>>>      https://listserv.fysik.dtu.dk/mailman/listinfo/ase-users
>>>>      <https://listserv.fysik.dtu.dk/mailman/listinfo/ase-users>
>>>>
>>>>
>>>>
>>>>
>>>> --
>>>> ------------------------------------------
>>>> PD Dr Michael Walter
>>>> Addresses:
>>>> - Fraunhofer IWM, Wöhlerstrasse 11, D-79108 Freiburg i. Br., Germany
>>>>    Tel.: +49 761 5142 296
>>>> - FIT Freiburg Centre for Interactive Materials and Bioinspired
>>>> Technologies, Georges-Köhler-Allee 105, 79110 Freiburg, Germany
>>>>    Tel: +49 761 203 95072
>>>> email: Michael.Walter at fmf.uni-freiburg.de
>>>> <mailto:Michael.Walter at fmf.uni-freiburg.de>
>>>> www:
>>>> http://www.functional-nanosystems.uni-freiburg.de/People/PDWalter/group
>>>> publications: http://scholar.google.com/citations?user=vlmryKEAAAAJ&hl=en
>>>
>>> _______________________________________________
>>> ase-users mailing list
>>> ase-users at listserv.fysik.dtu.dk
>>> https://listserv.fysik.dtu.dk/mailman/listinfo/ase-users



More information about the ase-users mailing list