Author: bugman Date: Thu Jan 13 11:42:53 2011 New Revision: 12297 URL: http://svn.gna.org/viewcvs/relax?rev=12297&view=rev Log: Added a system test script for the model-free model tm4 relaxation data grid. Added: 1.3/test_suite/system_tests/scripts/model_free/opt_tm4_grid.py - copied, changed from r12292, 1.3/test_suite/system_tests/scripts/model_free/opt_tm3_grid.py Copied: 1.3/test_suite/system_tests/scripts/model_free/opt_tm4_grid.py (from r12292, 1.3/test_suite/system_tests/scripts/model_free/opt_tm3_grid.py) URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/system_tests/scripts/model_free/opt_tm4_grid.py?p2=1.3/test_suite/system_tests/scripts/model_free/opt_tm4_grid.py&p1=1.3/test_suite/system_tests/scripts/model_free/opt_tm3_grid.py&r1=12292&r2=12297&rev=12297&view=diff ============================================================================== --- 1.3/test_suite/system_tests/scripts/model_free/opt_tm3_grid.py (original) +++ 1.3/test_suite/system_tests/scripts/model_free/opt_tm4_grid.py Thu Jan 13 11:42:53 2011 @@ -29,6 +29,7 @@ # The model-free parameters. tm = [2e-9, 10e-9, 21e-9] s2 = [0.2, 0.8, 0.95] +te = [2e-12, 40e-12] rex = [0.5, 4] # Create the sequence. @@ -42,10 +43,11 @@ # Loop over the parameters. for rex_index in range(len(rex)): - for s2_index in range(len(s2)): - for tm_index in range(len(tm)): - # Optimise and validate. - opt_and_check(spin=cdp.mol[0].res[res_index].spin[0], tm=tm[tm_index], s2=s2[s2_index], rex=rex[rex_index]) - - # Increment the residue index. - res_index += 1 + for te_index in range(len(te)): + for s2_index in range(len(s2)): + for tm_index in range(len(tm)): + # Optimise and validate. + opt_and_check(spin=cdp.mol[0].res[res_index].spin[0], tm=tm[tm_index], s2=s2[s2_index], te=te[te_index], rex=rex[rex_index]) + + # Increment the residue index. + res_index += 1