PLUMED-NEST

Project ID: plumID:21.034
Name: Efficient sampling of high-dimensional free energy landscapes using adaptive reinforced dynamics
Archive: https://github.com/dongdawn/rid/raw/master/examples/chignolin_plumed.zip
Category: bio
Keywords: reinforced dynamics, bias-exchange metadynamics, parallel-bias metadynamics
PLUMED version: 2.5
Contributor: Dongdong Wang
Submitted on: 15 Aug 2021
Publication: D. Wang, Y. Wang, J. Chang, L. Zhang, H. Wang, W. E., Efficient sampling of high-dimensional free energy landscapes using adaptive reinforced dynamics. Nature Computational Science. 2, 20–29 (2021)

PLUMED input files

File	Compatible with
BEMETA/00/plumed.0.dat
BEMETA/00/plumed_be-common.dat
BEMETA/01/plumed.0.dat
BEMETA/01/plumed_be-common.dat
BEMETA/02/plumed.0.dat
BEMETA/02/plumed_be-common.dat
PBMETA/02/plumed.dat
RiD/plumed.bf.dat
RiD/plumed.dat

Last tested: 22 Apr 2024, 20:49:33

Project description and instructions
Software used is GROMACS 2019.2 and PLUMED 2.5.2.

Submission history
[v1] 15 Aug 2021: original submission

Badge
Click on the image below and get the code to add the badge to your website!

[![plumID:21.034](https://www.plumed-nest.org/eggs/21/034/badge.svg)](https://www.plumed-nest.org/eggs/21/034/)

<a href="https://www.plumed-nest.org/eggs/21/034/"><img src="https://www.plumed-nest.org/eggs/21/034/badge.svg" alt="plumID:21.034"></a>