Changes

Version 3.3.0

http://svn.gna.org/svn/relax/tags/3.3.0

* Correction for catastrophic implementation of Monte Carlo simulations for exponential curve-fitting R2eff values in the dispersion analysis. A wrong implemented "else if" statement, would add the intensity for the simulated intensity together with the original intensity. This means that all intensity values send to minimisation would be twice as high than usually (if spectra were not replicated). This was discovered for Monte Carlo simulations of R2eff errors in exponential fit. This will affect all analyses using full relaxation exponential curves until now. By pure luck, it seems that the effect of this would be that R2eff errors are half the value they should be. A further investigation shows, that for the selected data set, this had a minimum on influence on the fitted parameters, because the chi2 value would be scaled up by a factor 4. Bug #22554 (https://gna.org/bugs/?22554): The distribution of intensity with errors in Monte Carlo simulations are markedly more narrow than expected. Task #7822 (https://gna.org/task/?7822): Implement user function to estimate R2eff and associated errors for exponential curve fitting.

* Added a minfx minimum version check to the dep_check module. This is to avoid problems such as that reported at bug #22408 (http://gna.org/bugs/?22408).

= See also =

[[Category:Release_Notes]]