#!/bin/bash -l
#$ -S /bin/bash
#$ -l h_rt=72:0:0
#$ -l mem=2G
#$ -N name_20150203_ddg_monomer_8398mutants_A111C
#$ -wd /home/ucbechz/Scratch/20150203_ddg_monomer_8398mutants/output/results/A111C

module unload compilers/intel/11.1/072
module unload mpi/qlogic/1.2.7/intel
module unload mkl/10.2.5/035
module load compilers/gnu/4.6.3
module load atlas/3.8.3/gnu.4.6.3
module load python/2.6.9/gnu.4.6.3
module load freetype/2.5.3/gnu.4.6.3
module load rosetta/2014.34.57213
module load pyrosetta/r56316
module load glew/1.11.0/gnu.4.6.3
module load pymol/1.7.2.1

cd $TMPDIR

ddg_monomer.linuxgccrelease @ /home/ucbechz/Scratch/20150203_ddg_monomer_8398mutants/input/options/A111C.options > ddg.log

# This copies all your results from TMPDIR back into Scratch. You can put them wherever you want in Scratch.
tar zcvf $HOME/Scratch/20150203_ddg_monomer_8398mutants/output/results/A111C/files_from_job_$JOB_ID.tar.gz $TMPDIR