Author: bugman Date: Sat Dec 2 05:51:51 2006 New Revision: 2905 URL: http://svn.gna.org/viewcvs/relax?rev=2905&view=rev Log: Ported r2849 from the 1.3 line. The commands used were: svn merge -r2848:2849 svn+ssh://bugman@xxxxxxxxxxx/svn/relax/1.3 svn merge -r2848:2849 svn+ssh://bugman@xxxxxxxxxxx/svn/relax/1.3/test_suite/ test_suite/system_tests The second command fixes the problem of the rearrangement of the test suite file layout. Modified: branches/test_suite/specific_fns/model_free.py branches/test_suite/test_suite/system_tests/angles.py branches/test_suite/test_suite/system_tests/model_free.py branches/test_suite/test_suite/system_tests/sequence.py Modified: branches/test_suite/specific_fns/model_free.py URL: http://svn.gna.org/viewcvs/relax/branches/test_suite/specific_fns/model_free.py?rev=2905&r1=2904&r2=2905&view=diff ============================================================================== --- branches/test_suite/specific_fns/model_free.py (original) +++ branches/test_suite/specific_fns/model_free.py Sat Dec 2 05:51:51 2006 @@ -3268,7 +3268,7 @@ # Read the PDB file (if it exists). if not pdb == 'None': - self.relax.generic.pdb.read(run=self.run, file=pdb, model=pdb_model, fail=0, print_flag=print_flag) + self.relax.generic.structure.read(run=self.run, file=pdb, model=pdb_model, fail=0, print_flag=print_flag) return 1 else: return 0 @@ -3461,7 +3461,7 @@ raise RelaxError, "The XH unit vector " + self.file_line[self.col['xh_vect']] + " is invalid." # Set the vector. - self.relax.generic.pdb.set_vector(run=self.run, res=self.res_index, xh_vect=xh_vect) + self.relax.generic.structure.set_vector(run=self.run, res=self.res_index, xh_vect=xh_vect) def remove_tm(self, run, res_num): Modified: branches/test_suite/test_suite/system_tests/angles.py URL: http://svn.gna.org/viewcvs/relax/branches/test_suite/test_suite/system_tests/angles.py?rev=2905&r1=2904&r2=2905&view=diff ============================================================================== --- branches/test_suite/test_suite/system_tests/angles.py (original) +++ branches/test_suite/test_suite/system_tests/angles.py Sat Dec 2 05:51:51 2006 @@ -40,10 +40,10 @@ self.relax.interpreter._Run.create(run, 'mf') # Read a PDB file. - self.relax.interpreter._PDB.read(run, file='test.pdb', dir=sys.path[-1] + '/test_suite/system_tests/data', model=1) + self.relax.interpreter._Structure.read_pdb(run, file='test.pdb', dir=sys.path[-1] + '/test_suite/system_tests/data', model=1) # Set the NH vector. - self.relax.interpreter._PDB.vectors(run, heteronuc='N', proton='H') + self.relax.interpreter._Structure.vectors(run, heteronuc='N', proton='H') # Initialise a diffusion tensor. self.relax.interpreter._Diffusion_tensor.init(run, (1.698e7, 1.417e7, 67.174, -83.718), param_types=3) Modified: branches/test_suite/test_suite/system_tests/model_free.py URL: http://svn.gna.org/viewcvs/relax/branches/test_suite/test_suite/system_tests/model_free.py?rev=2905&r1=2904&r2=2905&view=diff ============================================================================== --- branches/test_suite/test_suite/system_tests/model_free.py (original) +++ branches/test_suite/test_suite/system_tests/model_free.py Sat Dec 2 05:51:51 2006 @@ -281,8 +281,8 @@ self.relax.interpreter._Sequence.read(self.run, file='noe.500.out', dir=path) # Read the PDF file and set the vectors. - self.relax.interpreter._PDB.read(run, file='pdb', dir=path, model=1, load_seq=0) - self.relax.interpreter._PDB.vectors(run, heteronuc='N', proton='H') + self.relax.interpreter._Structure.read_pdb(run, file='pdb', dir=path, model=1, load_seq=0) + self.relax.interpreter._Structure.vectors(run, heteronuc='N', proton='H') # Read the relaxation data. self.relax.interpreter._Relax_data.read(self.run, 'R1', '600', 600.0 * 1e6, 'r1.600.out', dir=path) Modified: branches/test_suite/test_suite/system_tests/sequence.py URL: http://svn.gna.org/viewcvs/relax/branches/test_suite/test_suite/system_tests/sequence.py?rev=2905&r1=2904&r2=2905&view=diff ============================================================================== --- branches/test_suite/test_suite/system_tests/sequence.py (original) +++ branches/test_suite/test_suite/system_tests/sequence.py Sat Dec 2 05:51:51 2006 @@ -53,7 +53,7 @@ self.relax.generic.runs.create(run, 'mf') # Read the sequence. - self.relax.interpreter._PDB.read(run, file='test.pdb', dir=sys.path[-1] + '/test_suite/system_tests/data', model=1, load_seq=1) + self.relax.interpreter._Structure.read_pdb(run, file='test.pdb', dir=sys.path[-1] + '/test_suite/system_tests/data', model=1, load_seq=1) # Success. return 1