Unsupported: Use of this version of PLUMED is not supported. More information on our Applications Support and Retention Policy.PLUMED is an open source library for free energy calculations in molecular systems which works together with some of the most popular molecular dynamics engines. Free energy calculations can be performed as a function of many order parameters with a particular focus on biological problems, using state of the art methods such as metadynamics, umbrella sampling and Jarzynski-equation based steered MD. The software, written in C++, can be easily interfaced with both fortran and C/C++ codes.
Accessing PLUMED 2.8.1-foss-2022a
To load the module for PLUMED 2.8.1-foss-2022a please use this command on the BEAR systems (BlueBEAR, BEAR Cloud VMs, and CaStLeS VMs):
module load bear-apps-unsupported/handbuilt/2019
module load PLUMED/2.8.1-foss-2022a
BEAR Apps Version
For more information visit the PLUMED website.
Last modified on 13th October 2023