====== PyRETIS - rare events in Python ====== {{ :tools:pyretis_logo.png?nolink&600 |}} PyRETIS is a Python library for rare event molecular simulations with emphasis on methods based on //transition interface sampling// and //replica exchange transition interface sampling//. It's documentation includes [[http://www.pyretis.org/examples/examples-cp2k-hydrogen.html| a full example]] using CP2K. For more information visit [[http://www.pyretis.org]].