Skip to content
Snippets Groups Projects
Commit 414b503d authored by Massimiliano Bonomi's avatar Massimiliano Bonomi
Browse files

list

parent 2ab1f5e1
No related branches found
No related tags found
No related merge requests found
......@@ -298,10 +298,9 @@ There are multiple ways to calculate the correct
statistical weight of each frame in your metadynamics trajectory and thus to reweight your simulation.
Two of these approaches are:
1) Weights are calculated by considering the time-dependence of the metadynamics bias
- Weights are calculated by considering the time-dependence of the metadynamics bias
potential \cite Tiwary_jp504920s;
2) Weights are calculated using the metadynamics bias potential obtained at the end of the
- Weights are calculated using the metadynamics bias potential obtained at the end of the
simulation and assuming a constant bias during the entire course of the simulation \cite Branduardi:2012dl.
In this exercise we will use the second method, which resembles the umbrella-sampling-like reweighting approach.
......
0% Loading or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment