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. Author manuscript; available in PMC: 2022 Feb 9.
Published in final edited form as: J Chem Theory Comput. 2022 Jan 19;18(2):638–649. doi: 10.1021/acs.jctc.1c01154

Figure 2.

Figure 2.

Reorganization of WESTPA 1.0 to WESTPA 2.0. In version 2.0, WESTPA is installed using Python and relies on only a single environment variable such that commands can be called directly through Python. To reflect these changes, we have updated our original suite of WESTPA tutorials for version 2.0 (https://github.com/westpa/westpa_tutorials/tree/westpa-2.0-restruct).36,37