#! /bin/tcsh
#SBATCH --job-name="xplor refine"

cd $SLURM_SUBMIT_DIR
/data/PNAI/yuba/software/xplor-nih-3.1/bin/xplor -py -smp 10 -num_threads 2 refine_dimer.py -inputfiles combined_allatom.pdb rna_cg.pdb  input.bpl -o out.log 
#sbatch --cpus-per-task=10 --threads-per-core=2 --mem=10g --time=2-00:00:00 --partition=ccr qsub2.sh
#/data/PNAI/yuba/software/xplor-nih-3.1/bin/slurmXplor -ntasks=10 -omp 2 refine_dimer.py   -inputfiles combined_allatom.pdb 920_cg.pdb  input_Y4J.bpl
