correct test results!

The old results have been wrong due to a centering bug in the RMSD code
MDAnalysis · Dec 29, 2016 · 98e0e00 · 98e0e00
1 parent aee2a60
commit 98e0e00
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/testsuite/MDAnalysisTests/analysis/test_rms.py b/testsuite/MDAnalysisTests/analysis/test_rms.py
@@ -149,7 +149,7 @@ def setUp(self):
         self.outfile = os.path.join(self.tempdir.name, 'rmsd.txt')
         self.correct_values = [[0, 0, 0], [49, 48.9999, 4.68953]]
         self.correct_values_group = [[0, 0, 0, 0, 0],
-                                     [49, 48.9999, 4.7857, 4.7002,
+                                     [49, 49, 4.7857, 4.7004,
                                       4.68981]]
 
     def tearDown(self):