From 23c24956552bf4b235eb3f5ceee441830b687bf6 Mon Sep 17 00:00:00 2001 From: Daniel Schwalbe-Koda Date: Fri, 13 May 2022 09:00:45 -0400 Subject: [PATCH] seeds for test_mcdocker --- VOID/dockers/tests/test_mcdocker.py | 4 +++- 1 file changed, 3 insertions(+), 1 deletion(-) diff --git a/VOID/dockers/tests/test_mcdocker.py b/VOID/dockers/tests/test_mcdocker.py index f621f71..e146d1a 100644 --- a/VOID/dockers/tests/test_mcdocker.py +++ b/VOID/dockers/tests/test_mcdocker.py @@ -16,7 +16,7 @@ def setUp(self): self.complex = Complex(self.host, self.guest) self.fitness = MinDistanceFitness(threshold=1.5) - self.num_steps = 100 + self.num_steps = 200 self.temperature = 0.1 self.mcdocker = MonteCarloDocker( @@ -25,10 +25,12 @@ def setUp(self): ) def test_run(self): + np.random.seed(28) cpx = self.mcdocker.run(self.complex.copy(), self.num_steps) self.assertTrue(cpx.distance_matrix.min() > 1.5) def test_dock(self): + np.random.seed(7) cpxs = self.mcdocker.dock(self.num_steps) self.assertIsInstance(cpxs, list) self.assertIsInstance(cpxs[0], Complex)