-
- Downloads
There was an error fetching the commit references. Please try again later.
Implemented RECT keyword for METAD
Allows specifying multiple BIASFACTORs in a single file. In addition, it triggers a citation to "altruistic" paper by Spiwok et al when using METAD with RECT and WALKERS_MPI. Notice that in this case the free-energy estimator is shared rather than the bias itself, so as to allow "altruistic" updates when walkers have different biasfactors (as in RECT).
Loading
Please register or sign in to comment