********>Bugfix.37:
Author: Ross Walker (reported by Mark Williamson)
Date: 02/28/2005
Programs: Sander and Sander.LES (mpi versions)
Description: The targeted MD test case only has two residues and so is not really
suitable for running in parallel since sander requires nres>nproc.
The failure of this test case can lead to the mistaken opinion that
the sander installation did not work. This bugfix ensures that this
test case is only run for single cpu tests.
Fix: apply the following patch to amber8/test/tgtmd/change_target.ntr/Run.tgtmd
------------------------------------------------------------------------------
--- test/tgtmd/change_target.ntr/Run.tgtmd 2005-02-28 14:33:36.000000000 -0800
+++ test/tgtmd/change_target.ntr/Run.tgtmd 2005-02-28 14:33:18.000000000 -0800
@@ -10,6 +10,10 @@
if( ! $?DO_PARALLEL ) then
setenv DO_PARALLEL " "
+else
+ echo "This test not set up for parallel"
+ echo "need #nres>#nproc"
+ exit 0
endif
touch dummy
------------------------------------------------------------------------------
Workarounds: Manually comment this test out of the amber8/test/Makefile when testing
a parallel implementation.