#include "config.h"
-#include <algorithm>
-
#include <assert.h>
#include <math.h>
#include <stdio.h>
#include <string.h>
#include <time.h>
-#include "gromacs/bonded/bonded.h"
+#include <algorithm>
+
#include "gromacs/fileio/gmxfio.h"
#include "gromacs/fileio/pdbio.h"
#include "gromacs/imd/imd.h"
#include "gromacs/legacyheaders/pme.h"
#include "gromacs/legacyheaders/shellfc.h"
#include "gromacs/legacyheaders/typedefs.h"
+#include "gromacs/listed-forces/bonded.h"
#include "gromacs/math/vec.h"
#include "gromacs/mdlib/nb_verlet.h"
#include "gromacs/mdlib/nbnxn_search.h"
/* Only forces in domains near the PBC boundaries need to
consider PBC in the treatment of fshift */
bShiftForcesNeedPbc = (dd->ci[dd->dim[d]] == 0);
- bScrew = (bShiftForcesNeedPbc && dd->bScrewPBC && dd->dim[d] == XX);
+ bScrew = (bShiftForcesNeedPbc && dd->bScrewPBC && dd->dim[d] == XX);
if (fshift == NULL && !bScrew)
{
bShiftForcesNeedPbc = FALSE;