projects
/
django_unres.git
/ blobdiff
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
raw
|
inline
| side by side
correct t_bath in histogram
[django_unres.git]
/
django_simple
/
todo
/
jobfiles.py
diff --git
a/django_simple/todo/jobfiles.py
b/django_simple/todo/jobfiles.py
index
a569298
..
af0b2c4
100644
(file)
--- a/
django_simple/todo/jobfiles.py
+++ b/
django_simple/todo/jobfiles.py
@@
-231,7
+231,7
@@
CUTOFF=7.00000 WCORR4=0.00000
f1 = open('../files/pbs_md_new.csh', 'r')
f2 = open('pbs.csh', 'w')
for line in f1:
f1 = open('../files/pbs_md_new.csh', 'r')
f2 = open('pbs.csh', 'w')
for line in f1:
- f2.write(line.replace('$dimen3',str(dimen3) ))
+ f2.write(line.replace('$dimen3',str(dimen3)+' '+str(instance.md_temp) ))
f1.close()
f2.close()
f1.close()
f2.close()