Support more complex fixed position selections

[alexxy/gromacs.git] / src / gromacs / selection / poscalc.cpp

diff --git a/src/gromacs/selection/poscalc.cpp b/src/gromacs/selection/poscalc.cpp
index f193abd42c577b1445fc4d4707a106080528671e..616ca1a0584abc48182b27ca8a33c44b54a3660e 100644 (file)
--- a/src/gromacs/selection/poscalc.cpp
+++ b/src/gromacs/selection/poscalc.cpp
@@ -1,7 +1,7 @@
 /*
  * This file is part of the GROMACS molecular simulation package.
  *
- * Copyright (c) 2009,2010,2011,2012,2013,2014, by the GROMACS development team, led by
+ * Copyright (c) 2009,2010,2011,2012,2013,2014,2015, 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.
@@ -1066,7 +1066,7 @@ gmx_ana_poscalc_init_pos(gmx_ana_poscalc_t *pc, gmx_ana_pos_t *p)
     {
         gmx_ana_indexmap_set_static(&p->m, &pc->b);
     }
-    gmx_ana_pos_reserve(p, p->m.mapb.nr, 0);
+    gmx_ana_pos_reserve(p, p->m.mapb.nr, -1);
     if (pc->flags & POS_VELOCITIES)
     {
         gmx_ana_pos_reserve_velocities(p);