Changeset 6c96f4 for molecuilder/src

Timestamp:

May 21, 2008, 1:42:05 PM (17 years ago)

Author:

Frederik Heber <heber@…>

Children:

f75030

Parents:

a6e314

Message:

lots of small changes

-1 as either freq_start or freq_step lets VibrAlyzer determine necessary start and step values automatically by considering smallest and greatest possible determinably frequencies. Used start and step values are printed.
In parsing temperatures and timesteps counter-1 instead of counter was used as array index.
outer loop over frequency was done in a overly-correct manner (extra j for the loop, now we calculate freq_end and check for that.
command line values of start and step are now multiplied with 2*2*M_PI, so that they match ranges in the plot later.
Parsing of values was checked and is correct.

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