Merge branch release-2018

[alexxy/gromacs.git] / src / gromacs / mdlib / md_support.h

diff --git a/src/gromacs/mdlib/md_support.h b/src/gromacs/mdlib/md_support.h
index 20bbcc8b0bbeff83e0b7203cde0d4fd2703b2dac..e6b092da974e4384e2f71d782f4bbc5174fba0d3 100644 (file)
--- a/src/gromacs/mdlib/md_support.h
+++ b/src/gromacs/mdlib/md_support.h
@@ -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, by the GROMACS development team, led by
+ * Copyright (c) 2013,2014,2015,2016,2017,2018, 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.
@@ -64,6 +64,8 @@ class SimulationSignaller;
  * passed to compute_globals in md.c and global_stat.
  */
 
+/* we are initializing and not yet in the actual MD loop */
+#define CGLO_INITIALIZATION (1<<1)
 /* we are computing the kinetic energy from average velocities */
 #define CGLO_EKINAVEVEL     (1<<2)
 /* we are removing the center of mass momenta */