*
* Copyright (c) 1991-2000, University of Groningen, The Netherlands.
* Copyright (c) 2001-2004, The GROMACS development team.
- * Copyright (c) 2013, by the GROMACS development team, led by
+ * Copyright (c) 2013,2014, 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 <stdlib.h>
#include <math.h>
-#include "typedefs.h"
-#include "gromacs/fileio/futil.h"
-#include "macros.h"
-#include "physics.h"
-#include "smalloc.h"
-#include "gstat.h"
+#include <stdlib.h>
+
#include "gromacs/fileio/matio.h"
-#include "copyrite.h"
-#include "gmx_fatal.h"
+#include "gromacs/gmxana/gstat.h"
+#include "gromacs/legacyheaders/copyrite.h"
+#include "gromacs/legacyheaders/macros.h"
+#include "gromacs/legacyheaders/typedefs.h"
+#include "gromacs/math/units.h"
+#include "gromacs/utility/fatalerror.h"
+#include "gromacs/utility/futil.h"
+#include "gromacs/utility/smalloc.h"
typedef struct {
int nx, ny;
}
}
sprintf(buf, "%s.xpm", fn);
- fp = ffopen(buf, "w");
+ fp = gmx_ffopen(buf, "w");
write_xpm(fp, 0, fn, fn, "Phi", "Psi", nnx, nny,
x_phi, y_psi, newdata, lo, hi, rlo, rhi, &nlevels);
for (i = 0; (i < nnx); i++)
}
sd->data[i][j] = sd->data[i][0];
}
- ffclose(fp);
+ gmx_ffclose(fp);
if (bDebugMode())
{