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Remove use of graph in do_force()
[alexxy/gromacs.git]
/
src
/
gromacs
/
mdtypes
/
state.cpp
diff --git
a/src/gromacs/mdtypes/state.cpp
b/src/gromacs/mdtypes/state.cpp
index 46711fe9413a8d1db9c03bd8bca6af3f2b667ae2..61c280f997638ae99c8587c0f599acba707fd351 100644
(file)
--- a/
src/gromacs/mdtypes/state.cpp
+++ b/
src/gromacs/mdtypes/state.cpp
@@
-260,7
+260,7
@@
t_state::t_state() :
void set_box_rel(const t_inputrec* ir, t_state* state)
{
/* Make sure the box obeys the restrictions before we fix the ratios */
- correct_box(nullptr, 0, state->box
, nullptr
);
+ correct_box(nullptr, 0, state->box);
clear_mat(state->box_rel);