Fix benzene PBC MD test (#219)

54ab56ee · Gao, Xiang · GitHub · 71b9c75f · 71b9c75f · 54ab56ee
Unverified Commit 54ab56ee authored May 14, 2019 by Gao, Xiang Committed by GitHub May 14, 2019
5 changed files
--- a/tests/test_data/benzene-md/99.dat
+++ b/tests/test_data/benzene-md/99.dat
--- a/tests/test_energies.py
+++ b/tests/test_energies.py
--- a/tests/test_forces.py
+++ b/tests/test_forces.py
--- a/tools/generate-unit-test-expect/benzene-md.py
+++ b/tools/generate-unit-test-expect/benzene-md.py
--- a/tools/generate-unit-test-expect/others/Benzene.pdb
+++ b/tools/generate-unit-test-expect/others/Benzene.pdb