Improve use of gmxpreprocess headers

[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / specbond.cpp

diff --git a/src/gromacs/gmxpreprocess/specbond.cpp b/src/gromacs/gmxpreprocess/specbond.cpp
index a7e9ee784ac78f40d7a36002fe3dc04980a28838..e4f303244def680b2e1e5fd7561d1b7ab7354475 100644 (file)
--- a/src/gromacs/gmxpreprocess/specbond.cpp
+++ b/src/gromacs/gmxpreprocess/specbond.cpp
@@ -3,7 +3,7 @@
  *
  * Copyright (c) 1991-2000, University of Groningen, The Netherlands.
  * Copyright (c) 2001-2004, The GROMACS development team.
- * Copyright (c) 2013,2014,2015,2016,2017,2018, by the GROMACS development team, led by
+ * Copyright (c) 2013,2014,2015,2016,2017,2018,2019, 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.
@@ -52,6 +52,15 @@
 #include "gromacs/utility/smalloc.h"
 #include "gromacs/utility/strdb.h"
 
+struct t_specbond
+{
+    char *res1, *res2;
+    char *atom1, *atom2;
+    char *newres1, *newres2;
+    int   nbond1, nbond2;
+    real  length;
+};
+
 bool yesno()
 {
     char c;