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updated the molc unit test (it was crashing earlier)
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jewettaij committed Apr 6, 2022
1 parent 962eda2 commit 530df8d
Showing 1 changed file with 6 additions and 4 deletions.
10 changes: 6 additions & 4 deletions tests/test_molc.sh
Original file line number Diff line number Diff line change
@@ -1,10 +1,12 @@
#!/usr/bin/env bash

test_oplsaa() {
cd test_molc_files/
moltemplate.sh -atomstyle "hybrid molecular ellipsoid" -molc system.lt
assertTrue "system.data file not created" "[ -s system.data ]"
assertTrue "system.in.settings file not created" "[ -s system.in.settings ]"
cd tests/
cd test_molc_files/
moltemplate.sh -atomstyle "hybrid molecular ellipsoid" -molc system.lt
assertTrue "system.data file not created" "[ -s system.data ]"
assertTrue "system.in.settings file not created" "[ -s system.in.settings ]"
cd ../
cd ../
}

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