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PLUMED
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.
You can find documentation on the system, with the command 'module help plumed
- The manual is on the web at the original home page (https://www.plumed.org/doc-v2.7/user-doc/html/index.html)
CINECA consultants can be reached through the address: superc@cineca.it'''
contact = a.grottesi@cineca.it