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(parent: dcfb0cb) | patch
Added first tests of bonded force functions.
authorDavid van der Spoel <spoel@xray.bmc.uu.se>
Thu, 18 Aug 2016 08:04:33 +0000 (10:04 +0200)
committerDavid van der Spoel <davidvanderspoel@gmail.com>
Fri, 18 Nov 2016 15:36:21 +0000 (16:36 +0100)
commit10ad6f53f60708bc3c2f030c5b7be1867f12c304
tree2f715c3262599ab0f36193798fcc834eba19e059tree | snapshot
parentdcfb0cb634e01e996abf9ac08ea9b0e0ea9b0bc2commit | diff
Added first tests of bonded force functions.

Tests for bond_angle and dih_angle functions.
Some tests for bondeds, angles and dihedrals.
Part of #2034

Change-Id: I53835ff6fea98e8163505126d347150b64262770
18 files changed:
src/gromacs/listed-forces/CMakeLists.txt diff | blob | history
src/gromacs/listed-forces/tests/CMakeLists.txt [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/bonded.cpp [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_BondAnglePbcNone.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_BondAnglePbcXy.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_BondAnglePbcXyz.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_DihedarlAnglePbcXyz.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_DihedralAnglePbcNone.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_DihedralAnglePbcXy.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncAnglesPbcNo.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncAnglesPbcXYZ.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncAnglesPbcXy.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncBondsPbcNo.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncBondsPbcXy.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncBondsPbcXyz.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncProperDihedralsPbcNo.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncProperDihedralsPbcXy.xml [new file with mode: 0644] blob
src/gromacs/listed-forces/tests/refdata/BondedTest_IfuncProperDihedralsPbcXyz.xml [new file with mode: 0644] blob
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