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

[Ask Hjorth Larsen]

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
>>
>>     _______________________________________________
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>>     <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
>
>
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