static void set_default_time_unit(const char *time_list[], gmx_bool bCanTime)
{
int i,j;
- const char *select;
+ const char *select = NULL;
if (bCanTime)
{
integer less than, equal to, or greater than 0 if \p s1 less than,
identical to, or greater than \p s2.
*/
-static gmx_bool isStringEqNCase(const string s1, const string s2)
+static gmx_bool isStringEqNCase(const string& s1, const string& s2)
{
return (gmx_strncasecmp(s1.c_str(), s2.c_str(), max(s1.length(), s2.length())) == 0);
}
return min1-min2;
}
-static int icomp(const void *p1, const void *p2)
-{
- atom_id *a1=(atom_id *)p1;
- atom_id *a2=(atom_id *)p2;
-
- return (*a1)-(*a2);
-}
-
int n_flexible_constraints(struct gmx_constr *constr)
{
int nflexcon;
case econqCoord:
csettle(constr->settled,
nsettle,settle->iatoms,x[0],xprime[0],
- invdt,v[0],vir!=NULL,rmdr,&error,&vetavar);
+ invdt,v?v[0]:NULL,vir!=NULL,rmdr,&error,&vetavar);
inc_nrnb(nrnb,eNR_SETTLE,nsettle);
if (v != NULL)
{
if (subdivision(i))
{
print_cycles(fplog,c2t,wcn[i],
- (i>=ewcPMEMESH || i<=ewcPME_SOLVE) ? npme : npp,
+ (i>=ewcPMEMESH && i<=ewcPME_SOLVE) ? npme : npp,
wc->wcc[i].n,cycles[i],tot);
}
}