Tests for polarization functions.
authorDavid van der Spoel <spoel@xray.bmc.uu.se>
Sun, 3 Feb 2019 07:49:19 +0000 (08:49 +0100)
committerDavid van der Spoel <spoel@xray.bmc.uu.se>
Mon, 11 Feb 2019 16:41:09 +0000 (17:41 +0100)
commit9ec7699c7c574353fb18424db9a3bd602c2d880d
tree235ce4eb2eeca6bde423a2ce9a5780910bf64300
parenta543a74f6cb9347a326f387dd6ea7dd7980daee6
Tests for polarization functions.

Part of #2795

Change-Id: I30d0c67bac3e16412ca2afaa12ea7e28e8c01f6e
37 files changed:
src/gromacs/listed_forces/tests/bonded.cpp
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_0.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_1.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_10.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_11.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_12.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_13.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_14.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_15.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_16.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_17.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_18.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_19.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_2.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_20.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_21.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_22.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_23.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_24.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_25.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_26.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_27.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_28.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_29.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_3.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_30.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_31.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_32.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_33.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_34.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_35.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_4.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_5.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_6.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_7.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_8.xml [new file with mode: 0644]
src/gromacs/listed_forces/tests/refdata/Polarize_ListedForcesTest_Ifunc_9.xml [new file with mode: 0644]