/GabeditSrc240/utils/Gaussian/LSF/submitGaussian
Korn Shell | 34 lines | 33 code | 0 blank | 1 comment | 3 complexity | 0087d9bfa1fcb52ed7e29068b7a56405 MD5 | raw file
- #!/bin/ksh
- if test -z "$1"
- then
- echo "+--------------------------------------------------------------+"
- echo "! !"
- echo "! submitGaussian command : !"
- echo "! !"
- echo "! This command is used to submit Gaussian job with LSF !"
- echo "! !"
- echo "! Syntax: submitGaussian QUEUE dataFile.com !"
- echo "! !"
- echo "! type - type of queues(G,GL) !"
- echo "! G : under 172800 seconds(default) !"
- echo "! GL : under 604800 seconds !"
- echo "! dataFile.com - name of the input gaussian file !"
- echo "! !"
- echo "+--------------------------------------------------------------+"
- exit
- fi
- type=$1
- jobcom=$2
- echo $jobcom
- if [ ! -f "$jobcom" ]
- then
- echo I can not open $jobcom file
- exit
- fi
- if test -z "$type"
- then
- type=G
- fi
- job=${jobcom%.com}
- bsub -q $type -J $job -o $job.out -e $job.err "/home/allouche/shell/gauss $job"
- exit