Hi Edward.
I can make more points by:
cat CR72_point_1_N | awk '{print $1-0.5, $2+1, $3, 1}' >> CR72_point_1_N
sed -i "s/points = 1/points = 2/g" CR72_point_1_N.general
That will be my start
Best
Troels
2014-05-08 13:30 GMT+02:00 Edward d'Auvergne <[email protected]>:
> Hi Troels,
>
> Before making any changes to the OpenDX program, if you do plan to do
> this, please discuss it on the mailing list first. I have a lot of
> experience with OpenDX and how to handle multiple points, and I also
> know how to modify the lib.software.opendx package code in the best
> and simplest way for this support. It would come down to two steps.
> The first would be to shift the 'Glyph' page group into its own
> function. Then to loop over each point, calling that function to add
> one tab to the program per point. This way you don't have to deal
> with dynamic element layout and dynamic connections. The second step,
> collecting them together, will be more difficult. But, anyway, please
> discuss any changes before making them.
>
> Cheers,
>
> Edward
>
>
>
> On 8 May 2014 12:04, Edward d'Auvergne <[email protected]> wrote:
>> Hmmm, good question. Should this be hardcoded, or would you like to
>> have this as a user function argument? The GUI will be more
>> difficult. We could have the fixed set of colours listed by OpenDX
>> (see the 'color' input of the 'Color' element in the 'Glyph' tab of
>> the relax maps). Or we could use an RGB list. If you have both one
>> point or a list of points, then the GUI construction will be more
>> challenging. Maybe just defaulting to the OpenDX colours in the order
>> in OpenDX is best - the user can change these colours later in the
>> OpenDX program by editing the 'Color' elements.
>>
>> Note that the hardest part will be to create an OpenDX program in text
>> form which has variable number of glyphs. You should first create an
>> OpenDX program with 2 points by modifying one from dx.map, and seeing
>> what is involved.
>>
>> Regards,
>>
>> Edward
>>
>>
>>
>> On 8 May 2014 11:54, Troels Emtekær Linnet <[email protected]> wrote:
>>> Do you know, if the colors can be specified?
>>>
>>>
>>>
>>> 2014-05-08 11:53 GMT+02:00 Edward d'Auvergne <[email protected]>:
>>>> This is reasonable. You should create a system test before
>>>> implementing anything though. And the original [x, y, x] point should
>>>> be accepted as well as lists of points.
>>>>
>>>> Regards,
>>>>
>>>> Edward
>>>>
>>>>
>>>>
>>>> On 8 May 2014 11:50, Troels E. Linnet <[email protected]>
>>>> wrote:
>>>>> URL:
>>>>> <http://gna.org/task/?7791>
>>>>>
>>>>> Summary: the dx.map should accept a list of list with
>>>>> values
>>>>> for points.
>>>>> Project: relax
>>>>> Submitted by: tlinnet
>>>>> Submitted on: Thu 08 May 2014 09:50:07 AM UTC
>>>>> Should Start On: Thu 08 May 2014 12:00:00 AM UTC
>>>>> Should be Finished on: Fri 09 May 2014 12:00:00 AM UTC
>>>>> Category: relax's source code
>>>>> Priority: 7 - High
>>>>> Status: In Progress
>>>>> Percent Complete: 0%
>>>>> Assigned to: tlinnet
>>>>> Open/Closed: Open
>>>>> Discussion Lock: Any
>>>>> Effort: 0.00
>>>>>
>>>>> _______________________________________________________
>>>>>
>>>>> Details:
>>>>>
>>>>> The dx.map can accept a point [x, y, x]
>>>>> to map on the chi2 surface.
>>>>>
>>>>> dx.map(params=dx_params, map_type='Iso3D', spin_id=cur_spin_id,
>>>>> inc=ds.dx_inc,
>>>>> lower=None, upper=None, axis_incs=10, file_prefix=file_name_map,
>>>>> dir=ds.resdir, point=dx_set_val, point_file=file_name_point, remap=None)
>>>>>
>>>>> This should be expanded to:
>>>>> [[x1, y1, z1], [x2, y2, z2]]
>>>>>
>>>>> This is to allow, that one can have dynamic parameters points, that
>>>>> showed how
>>>>> data is generated, and a point which shows which point space was
>>>>> minimised to.
>>>>>
>>>>>
>>>>>
>>>>>
>>>>> _______________________________________________________
>>>>>
>>>>> Reply to this item at:
>>>>>
>>>>> <http://gna.org/task/?7791>
>>>>>
>>>>> _______________________________________________
>>>>> Message sent via/by Gna!
>>>>> http://gna.org/
>>>>>
>>>>>
>>>>> _______________________________________________
>>>>> relax (http://www.nmr-relax.com)
>>>>>
>>>>> This is the relax-devel mailing list
>>>>> [email protected]
>>>>>
>>>>> To unsubscribe from this list, get a password
>>>>> reminder, or change your subscription options,
>>>>> visit the list information page at
>>>>> https://mail.gna.org/listinfo/relax-devel
_______________________________________________
relax (http://www.nmr-relax.com)
This is the relax-devel mailing list
[email protected]
To unsubscribe from this list, get a password
reminder, or change your subscription options,
visit the list information page at
https://mail.gna.org/listinfo/relax-devel
