r19784 - /branches/relax_disp/test_suite/system_tests/relax_disp.py -- May 30, 2013 - 11:45

Author: bugman
Date: Thu May 30 11:45:39 2013
New Revision: 19784

URL: http://svn.gna.org/viewcvs/relax?rev=19784&view=rev
Log:
Added parameter checks to the Relax_disp.test_hansen_cpmg_data_LM63 system 
test.


Modified:
    branches/relax_disp/test_suite/system_tests/relax_disp.py

Modified: branches/relax_disp/test_suite/system_tests/relax_disp.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/relax_disp/test_suite/system_tests/relax_disp.py?rev=19784&r1=19783&r2=19784&view=diff
==============================================================================
--- branches/relax_disp/test_suite/system_tests/relax_disp.py (original)
+++ branches/relax_disp/test_suite/system_tests/relax_disp.py Thu May 30 
11:45:39 2013
@@ -73,16 +73,29 @@
         spin70 = cdp.mol[0].res[0].spin[0]
         spin71 = cdp.mol[0].res[1].spin[0]
         print("%-20s %-20s %-20s" % ("Parameter", "Value (:70)", "Value 
(:71)"))
-        print("%-20s %20.8g %20.8g" % ("R2 (500 MHz)", spin70.r2[0], 
spin71.r2[0]))
-        print("%-20s %20.8g %20.8g" % ("R2 (800 MHz)", spin70.r2[1], 
spin71.r2[1]))
-        print("%-20s %20.8g %20.8g" % ("phi_ex", spin70.phi_ex, 
spin71.phi_ex))
-        print("%-20s %20.8g %20.8g" % ("phi_ex (500 MHz)", spin70.phi_ex * 
cdp.spectrometer_frq_list[0]**2, spin71.phi_ex * 
cdp.spectrometer_frq_list[0]**2))
-        print("%-20s %20.8g %20.8g" % ("phi_ex (800 MHz)", spin70.phi_ex * 
cdp.spectrometer_frq_list[1]**2, spin71.phi_ex * 
cdp.spectrometer_frq_list[1]**2))
-        print("%-20s %20.8g %20.8g" % ("kex", spin70.kex, spin71.kex))
-        print("%-20s %20.8g %20.8g\n" % ("chi2", spin70.chi2, spin71.chi2))
-        print("%-20s %20.8g %20.8g" % ("CPMGFit Rex (500)", spin70.phi_ex * 
cdp.spectrometer_frq_list[0]**2 / spin70.kex, spin71.phi_ex * 
cdp.spectrometer_frq_list[0]**2 / spin71.kex))
-        print("%-20s %20.8g %20.8g" % ("CPMGFit Rex (800)", spin70.phi_ex * 
cdp.spectrometer_frq_list[1]**2 / spin70.kex, spin71.phi_ex * 
cdp.spectrometer_frq_list[1]**2 / spin71.kex))
-        print("%-20s %20.8g %20.8g" % ("CPMGFit tau", 2/spin70.kex, 
2/spin71.kex))
+        print("%-20s %20.15g %20.15g" % ("R2 (500 MHz)", spin70.r2[0], 
spin71.r2[0]))
+        print("%-20s %20.15g %20.15g" % ("R2 (800 MHz)", spin70.r2[1], 
spin71.r2[1]))
+        print("%-20s %20.15g %20.15g" % ("phi_ex", spin70.phi_ex, 
spin71.phi_ex))
+        print("%-20s %20.15g %20.15g" % ("phi_ex (500 MHz)", spin70.phi_ex * 
cdp.spectrometer_frq_list[0]**2, spin71.phi_ex * 
cdp.spectrometer_frq_list[0]**2))
+        print("%-20s %20.15g %20.15g" % ("phi_ex (800 MHz)", spin70.phi_ex * 
cdp.spectrometer_frq_list[1]**2, spin71.phi_ex * 
cdp.spectrometer_frq_list[1]**2))
+        print("%-20s %20.15g %20.15g" % ("kex", spin70.kex, spin71.kex))
+        print("%-20s %20.15g %20.15g\n" % ("chi2", spin70.chi2, spin71.chi2))
+        print("%-20s %20.15g %20.15g" % ("CPMGFit Rex (500)", spin70.phi_ex 
* cdp.spectrometer_frq_list[0]**2 / spin70.kex, spin71.phi_ex * 
cdp.spectrometer_frq_list[0]**2 / spin71.kex))
+        print("%-20s %20.15g %20.15g" % ("CPMGFit Rex (800)", spin70.phi_ex 
* cdp.spectrometer_frq_list[1]**2 / spin70.kex, spin71.phi_ex * 
cdp.spectrometer_frq_list[1]**2 / spin71.kex))
+        print("%-20s %20.15g %20.15g" % ("CPMGFit tau", 2/spin70.kex, 
2/spin71.kex))
+
+        # Checks for residue :70.
+        self.assertAlmostEqual(spin70.r2[0], 6.80619482210607)
+        self.assertAlmostEqual(spin70.r2[1], 6.67911678576503)
+        self.assertAlmostEqual(spin70.phi_ex, 1.25861556503355e-13)
+        self.assertAlmostEqual(spin70.kex, 4763.2543305315)
+        self.assertAlmostEqual(spin70.chi2, 106.393365216011)
+
+        # Checks for residue :71.
+        self.assertAlmostEqual(spin71.r2[0], 4.92684808998739)
+        self.assertAlmostEqual(spin71.phi_ex, 2.40420500312786e-14)
+        self.assertAlmostEqual(spin71.kex, 2543.15954874963)
+        self.assertAlmostEqual(spin71.chi2, 1.44240394418566)
 
 
     def test_hansen_cpmg_data_CR72(self):