BioD PNPI Git Repos - alexxy/gromacs.git/commit

biod.pnpi.spb.ru / alexxy / gromacs.git / commit

author	Mark Abraham <mark.j.abraham@gmail.com>
	Thu, 21 Oct 2021 09:11:40 +0000 (09:11 +0000)
committer	Andrey Alekseenko <al42and@gmail.com>
	Thu, 21 Oct 2021 09:11:40 +0000 (09:11 +0000)
commit	32c8fcc1dcd614881c5ccb141cad7f21b660c347
tree	eca203b6208b857d87c4a94a73c959c096a004e3	tree \| snapshot
parent	9cf1bd23abe8ac9a4e2638845d34ae1b1ccf19b7	commit \| diff

Refactor PME tests for better usability

Now there is a human-understandable name for the tests, and (where
possible) the input for each test is declarative rather than
procedural.

161 files changed:

src/gromacs/ewald/tests/pmegathertest.cpp		diff \| blob \| history
src/gromacs/ewald/tests/pmesolvetest.cpp		diff \| blob \| history
src/gromacs/ewald/tests/pmesplinespreadtest.cpp		diff \| blob \| history
src/gromacs/ewald/tests/pmetestcommon.cpp		diff \| blob \| history
src/gromacs/ewald/tests/pmetestcommon.h		diff \| blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_0.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_1.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_2.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_3.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_4.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_5.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_6.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_7.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_8.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_9.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_10.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_11.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_12.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_first_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_13.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_14.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_15.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_first_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_0.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_second_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_1.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_first_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_2.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_second_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_3.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_first_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_4.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_second_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_5.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_first_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_6.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_second_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffLJ_PmeSolveTest_ReproducesOutputs_7.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_first_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_0.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_second_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_1.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_first_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_2.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_second_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_3.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_first_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_4.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_tric_grid_16_12_28_gridvalues_second_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_5.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_first_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_6.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_tric_grid_9_7_23_gridvalues_second_eps_1_2_ewaldq_0_4_ewaldlj_0_7_method_Coulomb.xml	[moved from src/gromacs/ewald/tests/refdata/DifferentEwaldCoeffQ_PmeSolveTest_ReproducesOutputs_7.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_13_15_11_gridvalues_first_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_8.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_13_15_11_gridvalues_first_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_6.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_13_15_11_gridvalues_first_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_7.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_13_15_11_gridvalues_second_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_11.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_13_15_11_gridvalues_second_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_9.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_13_15_11_gridvalues_second_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_10.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_16_12_14_gridvalues_first_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_2.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_16_12_14_gridvalues_first_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_0.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_16_12_14_gridvalues_first_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_1.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_16_12_14_gridvalues_second_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_5.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_16_12_14_gridvalues_second_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_3.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_3_grid_16_12_14_gridvalues_second_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_4.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_13_15_11_gridvalues_first_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_20.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_13_15_11_gridvalues_first_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_18.xml with 86% similarity]	diff \| blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_13_15_11_gridvalues_first_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_19.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_13_15_11_gridvalues_second_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_23.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_13_15_11_gridvalues_second_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_21.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_13_15_11_gridvalues_second_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_22.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_16_12_14_gridvalues_first_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_14.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_16_12_14_gridvalues_first_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_12.xml with 86% similarity]	diff \| blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_16_12_14_gridvalues_first_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_13.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_16_12_14_gridvalues_second_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_17.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_16_12_14_gridvalues_second_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_15.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_4_grid_16_12_14_gridvalues_second_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_16.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_first_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_32.xml with 97% similarity]	diff \| blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_first_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_30.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_first_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_31.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_second_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_35.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_second_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_33.xml with 86% similarity]	diff \| blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_13_15_11_gridvalues_second_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_34.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_16_12_14_gridvalues_first_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_26.xml with 97% similarity]	diff \| blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_16_12_14_gridvalues_first_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_24.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_16_12_14_gridvalues_first_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_25.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_16_12_14_gridvalues_second_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_29.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_16_12_14_gridvalues_second_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_27.xml with 86% similarity]	diff \| blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_rect_order_5_grid_16_12_14_gridvalues_second_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_28.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_tric_order_3_grid_13_15_11_gridvalues_first_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_44.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_GatherTest_WorksWith_box_tric_order_3_grid_13_15_11_gridvalues_first_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput_PmeGatherTest_ReproducesOutputs_42.xml with 100% similarity]	blob \| history
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src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_4_grid_16_12_14_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput1_PmeSplineAndSpreadTest_ReproducesOutputs_8.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_4_grid_16_12_14_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput2_PmeSplineAndSpreadTest_ReproducesOutputs_8.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_4_grid_19_17_11_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput13_PmeSplineAndSpreadTest_ReproducesOutputs_9.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_4_grid_19_17_11_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput1_PmeSplineAndSpreadTest_ReproducesOutputs_9.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_4_grid_19_17_11_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput2_PmeSplineAndSpreadTest_ReproducesOutputs_9.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_5_grid_16_12_14_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput13_PmeSplineAndSpreadTest_ReproducesOutputs_10.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_5_grid_16_12_14_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput1_PmeSplineAndSpreadTest_ReproducesOutputs_10.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_5_grid_16_12_14_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput2_PmeSplineAndSpreadTest_ReproducesOutputs_10.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_5_grid_19_17_11_system_13_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput13_PmeSplineAndSpreadTest_ReproducesOutputs_11.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_5_grid_19_17_11_system_1_atom.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput1_PmeSplineAndSpreadTest_ReproducesOutputs_11.xml with 100% similarity]	blob \| history
src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_5_grid_19_17_11_system_2_atoms.xml	[moved from src/gromacs/ewald/tests/refdata/SaneInput2_PmeSplineAndSpreadTest_ReproducesOutputs_11.xml with 100% similarity]	blob \| history

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