PLUMED

PLUMED is a plugin that works with a large number of molecular dynamics codes. PLUMED can also work as a Command Line Tool to perform analysis on trajectories saved in most of the existing formats.

2.7.1

Documentation for this version

Installation path (NBD cluster):

/shared/work/NBD_Utilities/PLUMED/plumed-2.7.1_impi

Dependencies:

module load intel-oneapi
export LD_LIBRARY_PATH=/shared/work/NBD_Utilities/PLUMED/plumed-2.7.1_impi/lib:$LD_LIBRARY_PATH
export I_MPI_PMI_LIBRARY=/usr/lib64/libpmi.so