Project ID: plumID:19.054
Name: MetaFEP
Category: methods
Keywords: metadynamics, chemistry, free energy perturbation
PLUMED version: 2.3
Contributor: GiovanniMaria Piccini
Submitted on: 12 Jun 2019
Publication: submitted

PLUMED input files

File Compatible with
plumed.dat tested on v2.5 tested on master

Last tested: 18 Aug 2019, 14:15:39

Project description and instructions
A COLVAR file is present and a python script to run the MetaFEP free energy calculation. A README file illustrates how to produce a similar COLVAR file.

Submission history
[v1] 12 Jun 2019: original submission

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