To follow up on this, a separate message introduced
http://chemapps.stolaf.edu/jmol/zip/jmol-14.3.11_2014.12.04.zip
with new functionality that allows reading tab-separated and CSV file data
back into Jmol as atom properties.
Bob
On Wed, Dec 3, 2014 at 8:45 AM, Marc Chakiachvili <
marc.chakiachv...@gmail.com> wrote:
> I Successfully saved my data in file, using Robert method, thanks again,
> now in order to retrieve data, just have to load it with the data command
> this time ? or do I need to parse saved file to set property_qresno /
> property_qsimil to my atoms ?
>
> In a perfect world, I would like to do as in doc :
>
> "Jmol 12 Note: If you just want to assign a set of properties to a set of
> atoms, and you have the properties in a file as a list of numbers, you do
> not need the DATA command. Simply load the values straight into an atom
> property directly from the file:
>
> *{*}.property_xxx = load("myfile.dat")"*
>
> Marc
>
> Le Wed Dec 03 2014 at 15:37:18, Robert Hanson <hans...@stolaf.edu> a
> écrit :
>
>> On Wed, Dec 3, 2014 at 5:28 AM, Rolf Huehne <rhue...@fli-leibniz.de>
>> wrote:
>>
>>
>>> Before you run the script you
>>> should restore the original lines. Each line should either end with a
>>> semicolon (';') or a brace ('{' or '}'). If this is not the case for a
>>> line you see you must combine it with the next line.
>>>
>>>
>> I note that Jmol *math *in scripts can be continued pretty much as for
>> JavaScript and Java to the next line. The presence of the operator allows
>> this:
>>
>> print 3
>> + 2
>>
>>
>> print 3 +
>> 2
>>
>> The only think you cannot do is something like the following, where there
>> is no operator:
>>
>> background
>> red
>>
>>
>> Bob
>>
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>
>
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--
Robert M. Hanson
Larson-Anderson Professor of Chemistry
Chair, Department of Chemistry
St. Olaf College
Northfield, MN
http://www.stolaf.edu/people/hansonr
If nature does not answer first what we want,
it is better to take what answer we get.
-- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
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