Python wrapping code for gmxapi mdrun bindings.

[alexxy/gromacs.git] / python_packaging / src / gmxapi / simulation / __init__.py

diff --git a/python_packaging/src/gmxapi/simulation/__init__.py b/python_packaging/src/gmxapi/simulation/__init__.py
index 18ad0c30d451e1c4835ae0e1ab4b8a83e96c2d50..825349250d0be40bcac02e4a1aecc292c49422d7 100644 (file)
--- a/python_packaging/src/gmxapi/simulation/__init__.py
+++ b/python_packaging/src/gmxapi/simulation/__init__.py
@@ -31,3 +31,11 @@
 #
 # To help us fund GROMACS development, we humbly ask that you cite
 # the research papers on the package. Check out http://www.gromacs.org.
+"""GROMACS simulation subpackage for gmxapi.
+
+Provides operations for configuring and running molecular simulations.
+"""
+
+__all__ = ['mdrun']
+
+from .mdrun import mdrun