Fix gro file output with index groups
commitbc406d20f5158a46b06bddcd5876e1a6f087f28a
authorMark Abraham <mark.j.abraham@gmail.com>
Thu, 26 Sep 2019 17:54:20 +0000 (26 19:54 +0200)
committerMark Abraham <mark.j.abraham@gmail.com>
Fri, 27 Sep 2019 08:51:51 +0000 (27 10:51 +0200)
tree5916fbac0780e5582c5de68ecd492cf831f6004d
parente91fa76b9e80d88077c54c54c0aeb7aef4c956f5
Fix gro file output with index groups

Fixes #3107

Change-Id: I3fc586c69066a354b3210d9616125ef666f1ce26
src/gromacs/fileio/groio.cpp
src/gromacs/gmxpreprocess/tests/refdata/SinglePeptideFragments_EditconfTest_ProducesMatchingOutputStructureFileUsingIndexGroup_1.xml
src/gromacs/gmxpreprocess/tests/refdata/SinglePeptideFragments_EditconfTest_ProducesMatchingOutputStructureFileUsingIndexGroup_4.xml
src/gromacs/gmxpreprocess/tests/refdata/SinglePeptideFragments_EditconfTest_ProducesMatchingOutputStructureFileUsingIndexGroup_7.xml