Questions tagged [metadynamics]

Questions about Metadynamics, a method first suggested by by Alessandro Laio and Michele Parrinello in 2002.

Filter by
Sorted by
Tagged with
3 votes
1 answer

Interface between metadynamics and LAMMPS

I am trying to create an interface between the metadynamics and the LAMMPS code. Both the codes are written in two different languages. How can I proceed to create an interface. Thank you
Mangladeep Bhullar's user avatar
9 votes
0 answers

Is there any code that runs WHAM starting from histograms rather than time series? [closed]

I'm looking for a way to run the Weighted Histogram Analsys Method, but I don't have a time series to feed to the code as one would usually do, but rather I have histograms coming from the de-biasing ...
user3458909's user avatar