From 91d0764c9ef9fe49ece1fde355ecd1151556a3c4 Mon Sep 17 00:00:00 2001
From: Mark Driver <mdd31@cam.ac.uk>
Date: Thu, 20 Jul 2017 16:17:11 +0100
Subject: [PATCH] added missing assertion in test.
---
.../fractionaloccupancycalculatortest.py | 1 +
1 file changed, 1 insertion(+)
diff --git a/solventmapcreator/test/solvationcalculationtest/fractionaloccupancycalculatortest.py b/solventmapcreator/test/solvationcalculationtest/fractionaloccupancycalculatortest.py
index 9669876..54fa0ba 100644
--- a/solventmapcreator/test/solvationcalculationtest/fractionaloccupancycalculatortest.py
+++ b/solventmapcreator/test/solvationcalculationtest/fractionaloccupancycalculatortest.py
@@ -29,6 +29,7 @@ class FractionalOccupancyCalculatorTestCase(unittest.TestCase):
expected_value = (55.35 * 4.0 /300.0) + (0.001/300)
actual_value = fractionaloccupancycalculator.calculate_fractional_occupancy_for_phase("resources/watersolvent.xml",
"water", 0.001)
+ self.assertAlmostEqual(expected_value, actual_value)
def test_calculate_fractional_occupancy_contribution_from_solute(self):
"""Test to see if expected value is returned.
"""
--
GitLab