Elucidating Elastic Network Model Robustness by Parametrization with Molecular Dynamics

Validating and improving elastic network

Validating and improving elastic network models with molecular dynamics simulations

✍ Tod D. Romo; Alan Grossfield 📂 Article 📅 2010 🏛 John Wiley and Sons 🌐 English ⚖ 536 KB

## Abstract Elastic network models (ENMs) are a class of simple models intended to represent the collective motions of proteins. In contrast to all‐atom molecular dynamics simulations, the low computational investment required to use an ENM makes them ideal for speculative hypothesis‐testing situat