#!/bin/bash
#PBS -jeo
#PBS -r n
#PBS -l nodes=1:ppn=1

date
hostname
echo $PBS_JOBNAME

if [ -d ~/tinker/$PBS_JOBNAME ]; then
 export RUN_DIR=~/tinker/$PBS_JOBNAME
else
 export RUN_DIR=~/tinker
fi

cd ${RUN_DIR}
eval "/home/Andriy.Zhugayevych/local/tinker/bin/$(<$PBS_JOBNAME.tin)" >$PBS_JOBNAME.out

date