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List of works by Ruben Demuynck

Efficient Construction of Free Energy Profiles of Breathing Metal-Organic Frameworks Using Advanced Molecular Dynamics Simulations.

scientific article published on 13 November 2017

Light Olefin Diffusion during the MTO Process on H-SAPO-34: A Complex Interplay of Molecular Factors

scientific article published on 19 March 2020

On the intrinsic dynamic nature of the rigid UiO-66 metal-organic framework.

scientific article

Protocol for Identifying Accurate Collective Variables in Enhanced Molecular Dynamics Simulations for the Description of Structural Transformations in Flexible Metal-Organic Frameworks

scientific article published on 05 November 2018

The Importance of Cell Shape Sampling to Accurately Predict Flexibility in Metal-Organic Frameworks.

scientific article published on 14 February 2018

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