16 | 16 |
cd "${AUTOPKGTEST_TMP}"
|
17 | 17 |
|
18 | 18 |
gunzip -r *
|
19 | |
ls -R
|
20 | 19 |
cd data
|
21 | |
#do_stuff_to_test_package#
|
|
20 |
|
22 | 21 |
echo -e "\e[93m\e[1mTest 1\e[0m"
|
23 | 22 |
king-probe 6ins.pdb1 >> 6ins.kin
|
24 | 23 |
tail +2 6ins.kin > 6ins.kin.head
|
25 | |
tail +2 ../ref/6ins.kin > ../ref/6ins.kin.head
|
26 | |
diff 6ins.kin.head ../ref/6ins.kin.head
|
|
24 |
echo "2e8e38fca908f21e53f47bd3a9411219 6ins.kin.head" > checksum
|
|
25 |
md5sum --check checksum
|
27 | 26 |
echo -e "\e[92m\e[1mPassed\e[0m"
|
28 | 27 |
echo
|
29 | 28 |
|
30 | 29 |
echo -e "\e[93m\e[1mTest 2\e[0m"
|
31 | 30 |
king-probe -count -self all 6ins.pdb1 > 6ins.dotinfo.table
|
32 | 31 |
tail +2 6ins.dotinfo.table > 6ins.dotinfo.table.head
|
33 | |
tail +2 ../ref/6ins.dotinfo.table > ../ref/6ins.dotinfo.table.head
|
34 | |
diff 6ins.dotinfo.table.head ../ref/6ins.dotinfo.table.head
|
|
32 |
echo "23e6de91706f44a691ab0571ea50bcbb 6ins.dotinfo.table.head" > checksum
|
|
33 |
md5sum --check checksum
|
35 | 34 |
echo -e "\e[92m\e[1mPassed\e[0m"
|
36 | 35 |
echo
|
37 | 36 |
|
38 | 37 |
echo -e "\e[93m\e[1mTest 3\e[0m"
|
39 | 38 |
king-probe -unformated -self "all" 6ins.pdb1 > 6ins.rawinfo.table
|
40 | 39 |
tail +2 6ins.rawinfo.table > 6ins.rawinfo.table.head
|
41 | |
tail +2 ../ref/6ins.rawinfo.table > ../ref/6ins.rawinfo.table.head
|
42 | |
diff 6ins.rawinfo.table.head ../ref/6ins.rawinfo.table.head
|
|
40 |
echo "2a063119f359eb3ac5728788b372c8db 6ins.rawinfo.table.head" > checksum
|
|
41 |
md5sum --check checksum
|
43 | 42 |
echo -e "\e[92m\e[1mPassed\e[0m"
|
44 | 43 |
echo
|
45 | 44 |
|
46 | 45 |
echo -e "\e[93m\e[1mTest 4\e[0m"
|
47 | 46 |
king-probe -out all 6ins.pdb1 >> 6ins.surfacedots.kin
|
48 | 47 |
tail +2 6ins.surfacedots.kin > 6ins.surfacedots.kin.head
|
49 | |
tail +2 ../ref/6ins.surfacedots.kin > ../ref/6ins.surfacedots.kin.head
|
50 | |
diff 6ins.surfacedots.kin.head ../ref/6ins.surfacedots.kin.head
|
|
48 |
echo "bcea879aa884d7686e5213a9e9c935b4 6ins.surfacedots.kin.head" > checksum
|
|
49 |
md5sum --check checksum
|
51 | 50 |
echo -e "\e[92m\e[1mPassed\e[0m"
|
52 | 51 |
echo
|
53 | 52 |
|
54 | 53 |
echo -e "\e[93m\e[1mTest 5\e[0m"
|
55 | 54 |
king-probe -both chainE chainF 6ins.pdb1 >> 6insEF.kin
|
56 | 55 |
tail +2 6insEF.kin > 6insEF.kin.head
|
57 | |
tail +2 ../ref/6insEF.kin > ../ref/6insEF.kin.head
|
58 | |
diff 6insEF.kin.head ../ref/6insEF.kin.head
|
|
56 |
echo "29f07cd1e66b932f66db395264a6160a 6insEF.kin.head" > checksum
|
|
57 |
md5sum --check checksum
|
59 | 58 |
echo -e "\e[92m\e[1mPassed\e[0m"
|
60 | 59 |
echo
|
61 | 60 |
|
62 | 61 |
echo -e "\e[93m\e[1mTest 6\e[0m"
|
63 | 62 |
king-probe -once all all 6ins.pdb1 1zni.pdb1 >> 6ins_1zni.kin
|
64 | 63 |
tail +2 6ins_1zni.kin > 6ins_1zni.kin.head
|
65 | |
tail +2 ../ref/6ins_1zni.kin > ../ref/6ins_1zni.kin.head
|
66 | |
diff 6ins_1zni.kin.head ../ref/6ins_1zni.kin.head
|
|
64 |
echo "b14361cd9e8fe621e74174bc24042adb 6ins_1zni.kin.head" > checksum
|
|
65 |
md5sum --check checksum
|
67 | 66 |
echo -e "\e[92m\e[1mPassed\e[0m"
|
68 | 67 |
echo
|
69 | |
|