diff --git a/GoInt b/GoInt new file mode 100755 index 0000000..25eebd1 --- /dev/null +++ b/GoInt @@ -0,0 +1,17 @@ +#! /bin/bash + +set -e + +if [ $# -ne 2 ] +then + echo "You need two arguments [Molecule] [Basis] !!" +fi + +if [ $# = 2 ] +then + cp examples/molecule."$1" input/molecule + cp examples/basis."$1"."$2" input/basis + cp examples/basis."$1"."$2" input/weight + ./bin/IntPak +fi +