Jérôme Hénin

22PUBLICATIONS
65CO-AUTHORS
Computational chemistryCondensed matter modelling and density functional theoryElectrical energy generation (incl. renewables, excl. photovoltaics)Biomolecular modelling and designStatistical mechanics in chemistry
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Publications (22)

|May 07, 2026
Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations.

|Mar 17, 2026
Molecular Signatures of Pressure-Induced Phase Transitions in a Lipid Bilayer.

Yanna Gautier, Guillaume Stirnemann, Jérôme Hénin

|Nov 24, 2025
Characterization of an Open-Channel Structure and Lateral Conduction Pathway in the Cation-Selective Pentameric Ligand-Gated Ion Channel, ELIC.

Mark J Arcario, Elizabeth J Wu-Chen, Jérôme Hénin

|Oct 01, 2025
Targeting RNA with small molecules using state-of-the-art methods provides highly predictive affinities of riboswitch inhibitors.

Narjes Ansari, Chengwen Liu, Florent Hédin

|Sep 23, 2025
Calculating Free-Energy Differences Using an Average Force: A Tutorial for Adaptive Biasing Force Simulations.

Radu A Talmazan, Haohao Fu, Mengchen Zhou

|Aug 21, 2025
k-Nearest Neighbor Adaptive Sampling, a Simple Tool to Efficiently Explore Conformational Space.

Evianne Rovers, Anvith Thudi, Jérôme Hénin

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Frequent Collaborators

4 joint publications

Grace Brannigan

4 joint publications

Louis Lagardère

3 joint publications

Jean-Philip Piquemal

3 joint publications

Christophe Chipot