3. Installing PLUMED2

PLUMED is an engine for free energy calculations.

We can install it via conda.

conda install -c conda-forge plumed

Compiling from source (if needed, likely not)

This is just a reminder: you don't need this!

pver=2.6.0

wget https://github.com/plumed/plumed2/releases/download/v2.6.0/plumed-$pver.tgz
tar -zxvf plumed-$pver.tgz
cd plumed-$pver
./configure --prefix=$HOME/Apps/plumed-$pver
make -j8
make install

mkdir -p $HOME/.modulefiles/plumed
cp $HOME/Apps/plumed-$pver/lib/plumed/modulefile $HOME/.modulefiles/plumed/$pver