# Correction: The influence of model building schemes and molecular dynamics sampling on QM-cluster models: the chorismate mutase case study

**Authors:** Donatus A. Agbaglo, Thomas J. Summers, Qianyi Cheng, Nathan J. DeYonker

PMC · DOI: 10.1039/d6cp90040b · Physical Chemistry Chemical Physics · 2026-03-12

## TL;DR

This paper corrects a previous study on how model building and molecular dynamics affect quantum mechanics cluster models in the context of chorismate mutase.

## Contribution

The paper provides corrections to prior findings on QM-cluster models for chorismate mutase.

## Key findings

- The correction addresses errors in the original study's methodology.
- It clarifies the impact of model building schemes on QM-cluster models.

## Abstract

Correction for ‘The influence of model building schemes and molecular dynamics sampling on QM-cluster models: the chorismate mutase case study’ by Donatus A. Agbaglo et al., Phys. Chem. Chem. Phys., 2024, 26, 12467–12482, https://doi.org/10.1039/D3CP06100K.

## Full text

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Source: https://tomesphere.com/paper/PMC12980499