A Unified Approach to Enhanced Sampling - https://arxiv.org/abs/2007.03055 PLUMED-NEST: https://www.plumed-nest.org/eggs/20/022
This repository contains all the input files and scripts needed to reproduce the results of the paper, and all the data used to produce the figures. Due to size limitations, most but not all the full trajectories are present.
The software used is PLUMED 2.7, GROMACS 2018.4, and LAMMPS (7 Aug 2019)
The OPES code provided is a beta version. It will be implemented as PLUMED module, and will use a slightly different syntax.