170 lines
5.5 KiB
Bash
Executable file
170 lines
5.5 KiB
Bash
Executable file
#!/bin/sh
|
|
#
|
|
# run_test
|
|
#
|
|
##########################################################################
|
|
# A couple of validity checks
|
|
if test ! $# -eq 0 ; then
|
|
echo 'usage: runtest'
|
|
echo ' '
|
|
exit -1
|
|
fi
|
|
|
|
temp_success="0"
|
|
/bin/rm -f output.txt outputa.txt
|
|
##########################################################################
|
|
prog=DH_graph_1
|
|
if test ! -x $prog ; then
|
|
echo $prog ' does not exist'
|
|
exit -1
|
|
fi
|
|
##########################################################################
|
|
/bin/rm -f test.out test.diff DH_graph_1.out
|
|
|
|
echo 'Testing the DH dilute act calculation - act vs I'
|
|
$prog DH_NaCl_dilute.xml > DH_graph_1.out
|
|
retnStat=$?
|
|
echo 'Making a comparison with the good saved solution: '
|
|
echo '--------------------------------------------------------------------------------'
|
|
diff DH_graph_1.out DH_NaCl_dilute_blessed.csv > diff.out
|
|
zres=$?
|
|
cat diff.out
|
|
echo '--------------------------------------------------------------------------------'
|
|
echo 'End of comparison'
|
|
if test "$zres" = "0" -a "$retnStat" = "0"; then
|
|
echo 'test dilute passed'
|
|
else
|
|
echo 'test dilute failed'
|
|
temp_success="1"
|
|
if [ $retnStat != "0" ]
|
|
then
|
|
echo "$prog returned with bad status, $retnStat, check output"
|
|
fi
|
|
fi
|
|
|
|
##########################################################################
|
|
/bin/rm -f test.out test.diff DH_NaCl_acommon.csv
|
|
|
|
echo 'Testing the DH dilute act calculation - act vs I'
|
|
$prog DH_NaCl_acommon.xml > DH_NaCl_acommon.csv
|
|
retnStat=$?
|
|
echo 'Making a comparison with the good saved solution: '
|
|
echo '--------------------------------------------------------------------------------'
|
|
diff DH_NaCl_acommon.csv DH_NaCl_acommon_blessed.csv > diff.out
|
|
zres=$?
|
|
cat diff.out
|
|
echo '--------------------------------------------------------------------------------'
|
|
echo 'End of comparison'
|
|
if test "$zres" = "0" -a "$retnStat" = "0"; then
|
|
echo 'test acommon passed'
|
|
else
|
|
echo 'test acommon failed'
|
|
temp_success="1"
|
|
if [ $retnStat != "0" ]
|
|
then
|
|
echo "$prog returned with bad status, $retnStat, check output"
|
|
fi
|
|
fi
|
|
|
|
##########################################################################
|
|
/bin/rm -f test.out test.diff DH_NaCl_acommon.csv
|
|
|
|
echo 'Testing the DH dilute act calculation - act vs I'
|
|
$prog DH_NaCl_acommon.xml > DH_NaCl_acommon.csv
|
|
retnStat=$?
|
|
echo 'Making a comparison with the good saved solution: '
|
|
echo '--------------------------------------------------------------------------------'
|
|
diff DH_NaCl_acommon.csv DH_NaCl_acommon_blessed.csv > diff.out
|
|
zres=$?
|
|
cat diff.out
|
|
echo '--------------------------------------------------------------------------------'
|
|
echo 'End of comparison'
|
|
if test "$zres" = "0" -a "$retnStat" = "0"; then
|
|
echo 'test acommon passed'
|
|
else
|
|
echo 'test acommon failed'
|
|
temp_success="1"
|
|
if [ $retnStat != "0" ]
|
|
then
|
|
echo "$prog returned with bad status, $retnStat, check output"
|
|
fi
|
|
fi
|
|
##########################################################################
|
|
/bin/rm -f test.out test.diff DH_NaCl_bdotak.csv
|
|
|
|
echo 'Testing the DH bdotak act calculation - act vs I'
|
|
$prog DH_NaCl_bdotak.xml > DH_NaCl_bdotak.csv
|
|
retnStat=$?
|
|
echo 'Making a comparison with the good saved solution: '
|
|
echo '--------------------------------------------------------------------------------'
|
|
diff DH_NaCl_bdotak.csv DH_NaCl_bdotak_blessed.csv > diff.out
|
|
zres=$?
|
|
cat diff.out
|
|
echo '--------------------------------------------------------------------------------'
|
|
echo 'End of comparison'
|
|
if test "$zres" = "0" -a "$retnStat" = "0"; then
|
|
echo 'test bdotak passed'
|
|
else
|
|
echo 'test bdotak failed'
|
|
temp_success="1"
|
|
if [ $retnStat != "0" ]
|
|
then
|
|
echo "$prog returned with bad status, $retnStat, check output"
|
|
fi
|
|
fi
|
|
|
|
##########################################################################
|
|
/bin/rm -f test.out test.diff DH_NaCl_NM.csv
|
|
|
|
echo 'Testing the DH NM act calculation - act vs I'
|
|
$prog DH_NaCl_NM.xml > DH_NaCl_NM.csv
|
|
retnStat=$?
|
|
echo 'Making a comparison with the good saved solution: '
|
|
echo '--------------------------------------------------------------------------------'
|
|
diff DH_NaCl_NM.csv DH_NaCl_NM_blessed.csv > diff.out
|
|
zres=$?
|
|
cat diff.out
|
|
echo '--------------------------------------------------------------------------------'
|
|
echo 'End of comparison'
|
|
if test "$zres" = "0" -a "$retnStat" = "0"; then
|
|
echo 'test NM passed'
|
|
else
|
|
echo 'test NM failed'
|
|
temp_success="1"
|
|
if [ $retnStat != "0" ]
|
|
then
|
|
echo "$prog returned with bad status, $retnStat, check output"
|
|
fi
|
|
fi
|
|
|
|
##########################################################################
|
|
/bin/rm -f test.out test.diff DH_NaCl_Pitzer.csv
|
|
|
|
echo 'Testing the DH Pitzer act calculation - act vs I'
|
|
$prog DH_NaCl_Pitzer.xml > DH_NaCl_Pitzer.csv
|
|
retnStat=$?
|
|
echo 'Making a comparison with the good saved solution: '
|
|
echo '--------------------------------------------------------------------------------'
|
|
diff DH_NaCl_Pitzer.csv DH_NaCl_Pitzer_blessed.csv > diff.out
|
|
zres=$?
|
|
cat diff.out
|
|
echo '--------------------------------------------------------------------------------'
|
|
echo 'End of comparison'
|
|
if test "$zres" = "0" -a "$retnStat" = "0"; then
|
|
echo 'test Pitzer passed'
|
|
else
|
|
echo 'test Pitzer failed'
|
|
temp_success="1"
|
|
if [ $retnStat != "0" ]
|
|
then
|
|
echo "$prog returned with bad status, $retnStat, check output"
|
|
fi
|
|
fi
|
|
##########################################################################
|
|
if test $temp_success = "0" ; then
|
|
echo 'Overall DH_graph_1 test passed'
|
|
echo "PASSED" > csvCode.txt
|
|
else
|
|
echo 'Overall DH_graph_1 test failed'
|
|
echo "FAILED" > csvCode.txt
|
|
fi
|