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CAR_MPTP

Repo for "Identifying the Most Probable Transition Path with Constant Advance Replicas".

./work: source codes for each simulated system;
./pycospath: source codes for the CAR path algorithms.

Zilin Song, You Xu, He Zhang, Ye Ding, and Jing Huang*
Identifying the Most Probable Transition Path with Constant Advance Replicas
J. Chem. Theory Comput. 20, 22, 9857–9870 (2024).