Run 400 iterations in test_replica_exchange_harmonic_oscillator

choderalab · Sep 24, 2018 · 48ccb4a · 48ccb4a
1 parent 6f2fc76
commit 48ccb4a
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/Yank/tests/test_sampling.py b/Yank/tests/test_sampling.py
@@ -182,7 +182,7 @@ def test_replica_exchange_harmonic_oscillator(verbose=False, verbose_simulation=
     move = mmtools.mcmc.LangevinDynamicsMove(timestep=2.0*unit.femtoseconds,
                                              collision_rate=20.0/unit.picosecond,
                                              n_steps=500, reassign_velocities=True)
-    simulation = ReplicaExchangeSampler(mcmc_moves=move, number_of_iterations=200)
+    simulation = ReplicaExchangeSampler(mcmc_moves=move, number_of_iterations=400)
 
     # Define file for temporary storage.
     with mmtools.utils.temporary_directory() as tmp_dir: