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Communications Biology|May 9, 2025
Viral fusion proteins of classes II and III recognize and reorganize complex biological membranesChetan S Poojari, Tobias Bommer, Jochen S HubJournal of Chemical Theory and Computation|January 7, 2026
BindFlow: A Free, User-Friendly Pipeline for Absolute Binding Free Energy Calculations Using Free Energy Perturbation or MM(PB/GB)SAAlejandro Martínez León, Lucas Andersen, Jochen S HubChemistry and Physics of Lipids|April 6, 2019
Steroid-steroid interactions in biological membranes: Cholesterol and cortisoneAdree Khondker, Jochen S Hub, Maikel C RheinstädterPNAS Nexus|March 6, 2025
How pore formation in complex biological membranes is governed by lipid composition, mechanics, and lateral sortingLeonhard J Starke, Christoph Allolio, Jochen S HubPhysical Chemistry Chemical Physics : PCCP|October 6, 2021
Propensity, free energy contributions and conformation of primary n-alcohols at a water surfaceVictor Ekholm, Carl Caleman, Jochen S Hub, et al.The Journal of Physical Chemistry. B|September 14, 2020
Cooperative Effects of an Antifungal Moiety and DMSO on Pore Formation over Lipid Membranes Revealed by Free Energy CalculationsGari Kasparyan, Chetan Poojari, Tomasz Róg, et al.Handbook of Experimental Pharmacology|December 20, 2008
Dynamics and energetics of permeation through aquaporins. What do we learn from molecular dynamics simulations?Jochen S Hub, Helmut Grubmüller, Bert L de GrootPhysical Chemistry Chemical Physics : PCCP|June 8, 2012
Organic molecules on the surface of water droplets--an energetic perspectiveJochen S Hub, Carl Caleman, David van der SpoelNature Communications|November 16, 2021
Free energies of membrane stalk formation from a lipidomics perspectiveChetan S Poojari, Katharina C Scherer, Jochen S HubBiophysical Journal|January 23, 2026
Transmembrane domains of fusion proteins promote stalk formation by inducing membrane disorderKatharina C Scherer, Chetan S Poojari, Jochen S HubPageof 10