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(parent: 7ad7ef9) | patch
Tests of restrained listed potentials.
authorDavid van der Spoel <spoel@xray.bmc.uu.se>
Mon, 11 Feb 2019 19:25:50 +0000 (20:25 +0100)
committerDavid van der Spoel <spoel@xray.bmc.uu.se>
Sat, 16 Feb 2019 11:41:48 +0000 (12:41 +0100)
commit289432736de7178fb39eb49afa64f161045cf0ca
tree11e552d972655f93f8fb5f6203593e310591143etree | snapshot
parent7ad7ef9441a6864bcdf9bf4ae3bd0a5843d8a026commit | diff
Tests of restrained listed potentials.

TODO:
- Tests of tabulated potentials.
- Tests of NMR related potentials.
- Tests of restrained angles.

Part of #2795

Change-Id: I27ebc7a5a8805cc92a8e00deb83e36ca3cd87a78
37 files changed:
src/gromacs/listed_forces/tests/bonded.cpp diff | blob | history
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_0.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_1.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_10.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_11.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_12.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_13.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_14.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_15.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_16.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_17.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_18.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_19.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_2.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_20.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_21.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_22.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_23.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_24.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_25.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_26.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_27.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_28.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_29.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_3.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_30.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_31.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_32.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_33.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_34.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_35.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_4.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_5.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_6.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_7.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_8.xml [new file with mode: 0644] blob
src/gromacs/listed_forces/tests/refdata/Restraints_ListedForcesTest_Ifunc_9.xml [new file with mode: 0644] blob
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