X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Fewald%2Ftests%2Frefdata%2FPme_GatherTest_WorksWith_box_tric_order_5_grid_16_12_14_gridvalues_second_system_1_atom.xml;fp=src%2Fgromacs%2Fewald%2Ftests%2Frefdata%2FSaneInput_PmeGatherTest_ReproducesOutputs_63.xml;h=bd4621e99bd12b42add954baef2d7383bf4acf01;hb=32c8fcc1dcd614881c5ccb141cad7f21b660c347;hp=a5acad9c82bfafb2c57bd13b073447de63f84ac4;hpb=9cf1bd23abe8ac9a4e2638845d34ae1b1ccf19b7;p=alexxy%2Fgromacs.git 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 a5acad9c82..bd4621e99b 100644 --- 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 @@ 1 - -16.500695458472013 + -16.500695458472016 -15.572010667113076 6.0618364657657224