From: Carsten Kutzner <ckutzne@gwdg.de>
Date: Tue, 14 Oct 2014 08:56:14 +0000 (+0200)
Subject: Fix order of ED/swap blocks during checkpoint reading.
X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=commitdiff_plain;h=d221cf330fa443aa0d6749725bdf3b45b256a519;p=alexxy%2Fgromacs.git

Fix order of ED/swap blocks during checkpoint reading.

For some reason the order of reading the swap state and the essential
dynamics (ED) state were mixed up in read_checkpoint(), which lead to
unreadable state files if both ED and swap functionality were used.
This fix changes the order of those blocks to be consistent with
write_checkpoint().

Change-Id: Ie234486b990861decef9e00fc5125f867001f814
---

diff --git a/src/gromacs/gmxlib/checkpoint.c b/src/gromacs/gmxlib/checkpoint.c
index 18c0a312a6..5f93ff28e5 100644
--- a/src/gromacs/gmxlib/checkpoint.c
+++ b/src/gromacs/gmxlib/checkpoint.c
@@ -2102,13 +2102,13 @@ static void read_checkpoint(const char *fn, FILE **pfplog,
         cp_error();
     }
 
-    ret = do_cpt_swapstate(gmx_fio_getxdr(fp), TRUE, &state->swapstate, NULL);
+    ret = do_cpt_EDstate(gmx_fio_getxdr(fp), TRUE, &state->edsamstate, NULL);
     if (ret)
     {
         cp_error();
     }
 
-    ret = do_cpt_EDstate(gmx_fio_getxdr(fp), TRUE, &state->edsamstate, NULL);
+    ret = do_cpt_swapstate(gmx_fio_getxdr(fp), TRUE, &state->swapstate, NULL);
     if (ret)
     {
         cp_error();