Merge branch 'bartek' of mmka.chem.univ.gda.pl:unres into bartek

[unres.git] / examples / unres / CSA / GAB / CSA / reminimize / output / fit.log

diff --git a/examples/unres/CSA/GAB/CSA/reminimize/output/fit.log b/examples/unres/CSA/GAB/CSA/reminimize/output/fit.log
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+
+
+*******************************************************************************
+Wed Jun 13 10:27:41 2012
+
+
+FIT:    data read from "1l2y_remini_GB000.stat" u 27:31
+        #datapoints = 200
+        residuals are weighted equally (unit weight)
+
+function used for fitting: f(x)
+fitted parameters initialized with current variable values
+
+
+
+Iteration 0
+WSSR        : 4599.97           delta(WSSR)/WSSR   : 0
+delta(WSSR) : 0                 limit for stopping : 1e-05
+lambda   : 2.99116
+
+initial set of free parameter values
+
+a               = 1
+b               = 1
+
+After 4 iterations the fit converged.
+final sum of squares of residuals : 0.148259
+rel. change during last iteration : -3.56824e-13
+
+degrees of freedom (ndf) : 198
+rms of residuals      (stdfit) = sqrt(WSSR/ndf)      : 0.0273639
+variance of residuals (reduced chisquare) = WSSR/ndf : 0.00074878
+
+Final set of parameters            Asymptotic Standard Error
+=======================            ==========================
+
+a               = -0.00629305      +/- 0.001687     (26.8%)
+b               = 0.317023         +/- 0.006933     (2.187%)
+
+
+correlation matrix of the fit parameters:
+
+               a      b      
+a               1.000 
+b              -0.960  1.000