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. Author manuscript; available in PMC: 2020 Jan 24.
Published in final edited form as: J Chem Theory Comput. 2014 Feb 11;10(2):524–533. doi: 10.1021/ct400606c

Table 1.

Operational Comparison of the Mean Forces and Swarms-of-Trajectories String Methodsa

mean forces swarms of trajectories
0 build initial path build initial path
1 restrained sampling to estimate mean forces short restrained sampling to prepare swarms
2 run swarms
3 evolve collective variables with estimate of mean forces evolve collective variables with estimate of drift
4 reparametrization reparametrization
a

Steps 1 to 4 are performed at each image and iterated until convergence.