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Fix rare UB / assertion failure in MdlibUnitTest
[alexxy/gromacs.git]
/
src
/
gromacs
/
mdlib
/
tests
/
leapfrogtestdata.cpp
diff --git
a/src/gromacs/mdlib/tests/leapfrogtestdata.cpp
b/src/gromacs/mdlib/tests/leapfrogtestdata.cpp
index 9d1f7780be68a05a173877aad803ecd15881f374..3f66855450e8cdec66b8e57c54b1db109c8429ac 100644
(file)
--- a/
src/gromacs/mdlib/tests/leapfrogtestdata.cpp
+++ b/
src/gromacs/mdlib/tests/leapfrogtestdata.cpp
@@
-170,6
+170,7
@@
LeapFrogTestData::LeapFrogTestData(int numAtoms,
mdAtoms_.haveVsites = false;
mdAtoms_.havePartiallyFrozenAtoms = false;
mdAtoms_.cFREEZE = nullptr;
+ mdAtoms_.ptype = nullptr;
update_ = std::make_unique<Update>(inputRecord_, nullptr);
update_->updateAfterPartition(numAtoms,