*
* Copyright (c) 1991-2000, University of Groningen, The Netherlands.
* Copyright (c) 2001-2004, The GROMACS development team.
- * Copyright (c) 2012, by the GROMACS development team, led by
+ * Copyright (c) 2012,2014, by the GROMACS development team, led by
* Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
* and including many others, as listed in the AUTHORS file in the
* top-level source directory and at http://www.gromacs.org.
* To help us fund GROMACS development, we humbly ask that you cite
* the research papers on the package. Check out http://www.gromacs.org.
*/
-#ifdef HAVE_CONFIG_H
-#include <config.h>
-#endif
+#include "gmxpre.h"
-#include <math.h>
-#include "smalloc.h"
-#include "sysstuff.h"
-#include "macros.h"
-#include "string2.h"
-#include "topdirs.h"
-#include "toputil.h"
-#include "topdirs.h"
#include "toputil.h"
-#include "symtab.h"
-#include "gmx_fatal.h"
-#include "gpp_atomtype.h"
+
+#include <assert.h>
+#include <math.h>
+#include <string.h>
+
+#include "gromacs/gmxpreprocess/gpp_atomtype.h"
+#include "gromacs/gmxpreprocess/topdirs.h"
+#include "gromacs/legacyheaders/macros.h"
+#include "gromacs/topology/block.h"
+#include "gromacs/topology/symtab.h"
+#include "gromacs/utility/fatalerror.h"
+#include "gromacs/utility/smalloc.h"
/* UTILITIES */
}
else
{
- gmx_fatal(FARGS, "Increase MAXSLEN in include/grompp.h to at least %d,"
+ gmx_fatal(FARGS, "Increase MAXSLEN in include/grompp-impl.h to at least %d,"
" or shorten your definition of bonds like %s to at most %d",
strlen(s)+1, s, MAXSLEN-1);
}
{
return;
}
- if ((pr->nr == 0) && (pr->param != NULL))
- {
- fprintf(stderr, "Warning: dangling pointer at %lx\n",
- (unsigned long)pr->param);
- pr->param = NULL;
- }
+ assert(!((pr->nr == 0) && (pr->param != NULL)));
if (pr->nr+extra > pr->maxnr)
{
pr->maxnr = max(1.2*pr->maxnr, pr->maxnr + extra);