X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Fewald%2Ftests%2Frefdata%2FPme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_first_system_13_atoms.xml;fp=src%2Fgromacs%2Fewald%2Ftests%2Frefdata%2FSaneInput_PmeGatherTest_ReproducesOutputs_32.xml;h=fe0b3dc6c2bf86a7e5c788c028aa5301e87c021d;hb=32c8fcc1dcd614881c5ccb141cad7f21b660c347;hp=79bbf3b0e2befe55ee9e09dd6dc309c6305f2fd9;hpb=9cf1bd23abe8ac9a4e2638845d34ae1b1ccf19b7;p=alexxy%2Fgromacs.git diff --git a/src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_32.xml b/src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_first_system_13_atoms.xml similarity index 97% rename from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_32.xml rename to src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_first_system_13_atoms.xml index 79bbf3b0e2..fe0b3dc6c2 100644 --- a/src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_32.xml +++ b/src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_first_system_13_atoms.xml @@ -6,7 +6,7 @@ -2.7819333917763145 -0.93764334824057782 - -0.2933831518353347 + -0.29338315183533475 0