Commit 2a3658d6 authored by Jason Swails's avatar Jason Swails
Browse files

Update the energy in anticipation of just uncommenting that test when the fix is

added.
parent fee9a5b8
......@@ -173,7 +173,7 @@ class TestAmberPrmtopFile(unittest.TestCase):
# ene = ene.value_in_unit(kilocalories_per_mole)
# # Make sure the energy is relatively close to the value we get with
# # Amber using this force field.
# self.assertAlmostEqual(-7042.3903307/ene, 1, places=3)
# self.assertAlmostEqual(-7099.44989739/ene, 1, places=3)
def test_NBFIX_noLongRange(self):
"""Test prmtop files with NBFIX LJ modifications w/out long-range correction"""
......
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