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Refactor PME tests for better usability
[alexxy/gromacs.git]
/
src
/
gromacs
/
ewald
/
tests
/
refdata
/
Pme_GatherTest_WorksWith_box_tric_order_5_grid_16_12_14_gridvalues_second_system_1_atom.xml
diff --git
a/src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_63.xml
b/src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_tric_order_5_grid_16_12_14_gridvalues_second_system_1_atom.xml
similarity index 86%
rename from
src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_63.xml
rename to
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_tric_order_5_grid_16_12_14_gridvalues_second_system_1_atom.xml
index a5acad9c82bfafb2c57bd13b073447de63f84ac4..bd4621e99bd12b42add954baef2d7383bf4acf01 100644
(file)
--- a/
src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_63.xml
+++ b/
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_tric_order_5_grid_16_12_14_gridvalues_second_system_1_atom.xml
@@
-4,7
+4,7
@@
<Sequence Name="Forces">
<Int Name="Length">1</Int>
<Vector>
- <Real Name="X">-16.50069545847201
3
</Real>
+ <Real Name="X">-16.50069545847201
6
</Real>
<Real Name="Y">-15.572010667113076</Real>
<Real Name="Z">6.0618364657657224</Real>
</Vector>