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#! /bin/bash
# script to run AutoDock automated tests (if "make" is not available)
# usage: (from source directory): cd $ARCHOSV; ../makecheck
#
# $Id: makecheck,v 1.2 2012/10/25 16:55:21 mp Exp $
#
echo "Running the Python3 test_autodock4.py unit-tests on ../autodock4"
outputdir=`pwd` ;\
umask 0 ;\
test -d $outputdir/Tests || mkdir $outputdir/Tests ;\
rm -f $outputdir/Tests/test_autodock4.py;\
cp ../AD4.1_bound.dat $outputdir/Tests;\
cp ../AD4_parameters.dat $outputdir/Tests;\
cp ../Tests/*.py $outputdir/Tests;\
cp ../Tests/*.dpf $outputdir/Tests;\
cp ../Tests/*.pdbqt $outputdir/Tests;\
cp ../Tests/*.map* $outputdir/Tests;\
cd Tests ; python3 ./test_autodock4.py -d . -e ../autodock4 -o .
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