Author

Díaz Leines

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2013

UvA-DARE ( Digital Academic Repository ) Path-metadynamics : A computational study of conformational transitions in proteins

The results demonstrate that path-metadynamics enables the calculation of rate constants, the localization of transition states, and the mapping of the free energy along a transition path described on a high-dimensional space.

Díaz Leines · 45 citations · ⚡1