OPES (On-the-fly Probability Enhanced Sampling)

Overview

The OPES module contains the implementation of the on-the-fly probability enhanced sampling mehtod (OPES) [62].

Installation

This module is not installed by default. Add '--enable-modules=opes' to your './configure' command when building PLUMED to enable these features. See also List of modules.

Usage

Currently, the OPES module is composed only by a bias action: OPES_METAD

Module Contents

• Biases
• Tutorials