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pro vyhledávání: '"Mouaffac, Line"'
Publikováno v:
J. Chem. Theory Comput. 2023, 19, 17, 5701
Finding optimal reaction coordinates and predicting accurate kinetic rates for activated processes are two of the foremost challenges of molecular simulations. We introduce an algorithm that tackles the two problems at once: starting from a limited n
Externí odkaz:
http://arxiv.org/abs/2302.12497
