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[alexxy/gromacs.git] / src / gromacs / mdlib / tests / watersystem.h

diff --git a/src/gromacs/mdlib/tests/watersystem.h b/src/gromacs/mdlib/tests/watersystem.h
index 29473b9ccd31779a93eeb6fb35e0aec151037545..bdab3ff7da68ab82105eea2f4a4aca586069aafd 100644 (file)
--- a/src/gromacs/mdlib/tests/watersystem.h
+++ b/src/gromacs/mdlib/tests/watersystem.h
@@ -1,7 +1,7 @@
 /*
  * This file is part of the GROMACS molecular simulation package.
  *
- * Copyright (c) 2018, by the GROMACS development team, led by
+ * Copyright (c) 2018,2019, by the GROMACS development team, led by
  * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
  * and including many others, as listed in the AUTHORS file in the
  * top-level source directory and at http://www.gromacs.org.
@@ -43,60 +43,24 @@ namespace test
 
 //! Database of 51 water atom input positions (taken from spc216.gro) for use as test inputs.
 static const std::array<gmx::RVec, 51> c_waterPositions(
-        { {
-              { .130, -.041, -.291 },
-              { .120, -.056, -.192 },
-              { .044, -.005, -.327 },
-              { -.854, -.406, .477 },
-              { -.900, -.334, .425 },
-              { -.858, -.386, .575 },
-              { .351, -.061, .853 },
-              { .401, -.147, .859 },
-              { .416, .016, .850 },
-              { -.067, -.796, .873 },
-              { -.129, -.811, .797 },
-              { -.119, -.785, .958 },
-              { -.635, -.312, -.356 },
-              { -.629, -.389, -.292 },
-              { -.687, -.338, -.436 },
-              { .321, -.919, .242 },
-              { .403, -.880, .200 },
-              { .294, -1.001, .193 },
-              { -.404, .735, .728 },
-              { -.409, .670, .803 },
-              { -.324, .794, .741 },
-              { .461, -.596, -.135 },
-              { .411, -.595, -.221 },
-              { .398, -.614, -.059 },
-              { -.751, -.086, .237 },
-              { -.811, -.148, .287 },
-              { -.720, -.130, .152 },
-              { .202, .285, -.364 },
-              { .122, .345, -.377 },
-              { .192, .236, -.278 },
-              { -.230, -.485, .081 },
-              { -.262, -.391, .071 },
-              { -.306, -.548, .069 },
-              { .464, -.119, .323 },
-              { .497, -.080, .409 },
-              { .540, -.126, .258 },
-              { -.462, .107, .426 },
-              { -.486, .070, .336 },
-              { -.363, .123, .430 },
-              { .249, -.077, -.621 },
-              { .306, -.142, -.571 },
-              { .233, -.110, -.714 },
-              { -.922, -.164, .904 },
-              { -.842, -.221, .925 },
-              { -.971, -.204, .827 },
-              { .382, .700, .480 },
-              { .427, .610, .477 },
-              { .288, .689, .513 },
-              { .781, .264, -.113 },
-              { .848, .203, -.070 },
-              { .708, .283, -.048 }
-          } });
+        { { { .130, -.041, -.291 },  { .120, -.056, -.192 },  { .044, -.005, -.327 },
+            { -.854, -.406, .477 },  { -.900, -.334, .425 },  { -.858, -.386, .575 },
+            { .351, -.061, .853 },   { .401, -.147, .859 },   { .416, .016, .850 },
+            { -.067, -.796, .873 },  { -.129, -.811, .797 },  { -.119, -.785, .958 },
+            { -.635, -.312, -.356 }, { -.629, -.389, -.292 }, { -.687, -.338, -.436 },
+            { .321, -.919, .242 },   { .403, -.880, .200 },   { .294, -1.001, .193 },
+            { -.404, .735, .728 },   { -.409, .670, .803 },   { -.324, .794, .741 },
+            { .461, -.596, -.135 },  { .411, -.595, -.221 },  { .398, -.614, -.059 },
+            { -.751, -.086, .237 },  { -.811, -.148, .287 },  { -.720, -.130, .152 },
+            { .202, .285, -.364 },   { .122, .345, -.377 },   { .192, .236, -.278 },
+            { -.230, -.485, .081 },  { -.262, -.391, .071 },  { -.306, -.548, .069 },
+            { .464, -.119, .323 },   { .497, -.080, .409 },   { .540, -.126, .258 },
+            { -.462, .107, .426 },   { -.486, .070, .336 },   { -.363, .123, .430 },
+            { .249, -.077, -.621 },  { .306, -.142, -.571 },  { .233, -.110, -.714 },
+            { -.922, -.164, .904 },  { -.842, -.221, .925 },  { -.971, -.204, .827 },
+            { .382, .700, .480 },    { .427, .610, .477 },    { .288, .689, .513 },
+            { .781, .264, -.113 },   { .848, .203, -.070 },   { .708, .283, -.048 } } });
 
-}  // namespace test
+} // namespace test
 
-}  // namespace gmx
+} // namespace gmx