Bug fix for irregular replex steps with GPU update
authorAlan Gray <alangray3@gmail.com>
Mon, 11 Oct 2021 12:42:49 +0000 (12:42 +0000)
committerMark Abraham <mark.j.abraham@gmail.com>
Mon, 11 Oct 2021 12:42:49 +0000 (12:42 +0000)
commit19418b1c4a5c8dcb3935b76a2af5db2f71cd1f22
tree066b7d5f64389eda4370eebfc598ef2a5033522a
parent96b3b814119015957d2658977fb73644e39d7ab3
Bug fix for irregular replex steps with GPU update
src/gromacs/mdrun/md.cpp
src/programs/mdrun/tests/CMakeLists.txt
src/programs/mdrun/tests/periodicactions.cpp
src/programs/mdrun/tests/periodicactions.h [new file with mode: 0644]
src/programs/mdrun/tests/periodicactions_basic.cpp [new file with mode: 0644]
src/programs/mdrun/tests/periodicactions_constraints.cpp [new file with mode: 0644]
src/programs/mdrun/tests/periodicactions_coupling.cpp [new file with mode: 0644]
src/programs/mdrun/tests/replicaexchange.cpp
src/programs/mdrun/tests/replicaexchange_equivalence.cpp [new file with mode: 0644]