const t_mdatoms &md);
bool apply(bool bLog,
bool bEner,
- gmx_int64_t step,
+ int64_t step,
int delta_step,
real step_scaling,
rvec *x,
}
//! Writes out domain contents to help diagnose crashes.
-static void dump_confs(FILE *log, gmx_int64_t step, const gmx_mtop_t &mtop,
+static void dump_confs(FILE *log, int64_t step, const gmx_mtop_t &mtop,
int start, int homenr, const t_commrec *cr,
const rvec x[], rvec xprime[], matrix box)
{
bool
Constraints::apply(bool bLog,
bool bEner,
- gmx_int64_t step,
+ int64_t step,
int delta_step,
real step_scaling,
rvec *x,
bool
Constraints::Impl::apply(bool bLog,
bool bEner,
- gmx_int64_t step,
+ int64_t step,
int delta_step,
real step_scaling,
rvec *x,
{
char buf[STRLEN];
sprintf(buf,
- "\nstep " "%" GMX_PRId64 ": One or more water molecules can not be settled.\n"
+ "\nstep " "%" PRId64 ": One or more water molecules can not be settled.\n"
"Check for bad contacts and/or reduce the timestep if appropriate.\n",
step);
if (log)