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Probably the last article release from our lab this year? An opinion article organized by George Rose just released online in PNAS: "Opinion: Protein folds vs. protein folding: Differing questions, different challenges" pnas.org/doi/10.1073/pn…

Martini model of an entire cell !!

Body transfer illusion The illusion of owning a part/or entire body other than one's own sight, touch and proprioception (a sense of body position) all combine to convince this person that a rubber hand is their body part 1/🧵 🔈This video has sound

Just out #openaccess JCIM & JCTC Journals our new work: "Automatic Optimization of Lipid Models in the Martini Force Field using SwarmCG"!🧐🤯✌️🥳🍾 pubs.acs.org/doi/10.1021/ac… Massive effort Charly Empereur-mot !🏋️‍♂️👏 Great collaboration with K. Pedersen PauloCTSouza & the Siewert-Jan Marrink group!🤝🙌

New preprint alert! With physicist colleagues in Toulouse, Siewert-Jan Marrink and Weria Pezeshkian we propose a methodological strategy to link nano and meso models to study curvature based lipid domains formation at different scales arxiv.org/abs/2401.05785

I'm happy to announce that our manuscript "Energetics of the Transmembrane Peptide Sorting by Hydrophobic Mismatch" with Balazs Fabian from Hummer Lab is out on bioRxiv! 🧵 doi.org/10.1101/2024.0…

S.Rao from our Hummer Lab & coworkers resolve mechanism of LC3 delivery to the phagophore membrane, a key step in selective #autophagy, by combining #MDsimulations & experiments. Three-step targeting of ATG12-ATG5-ATG16L1 machinery leads to LC3 lipidation👉science.org/doi/10.1126/sc…

New preprint from a nice collaboration between the @IpbsToulouse Integrative Biological NMR team and my lab ( LMGM CBI Toulouse ): "Coarse-graining the recognition of a glycolipid by the C-type lectin Mincle receptor " spearheaded by Maxime Noriega biorxiv.org/content/10.110…

Very happy to share my first work. Many thanks to matthieu Chavent Robin Corey @robincorey.bsky.social and everyone involved in the project for the help. I'd be happy to answer your questions/suggestions!

#compchem Just out in JCTC JCIM & JCTC Journals : Lambda-ABF: Simplified, Portable, Accurate, and Cost-effective Alchemical Free Energy Computation. doi.org/10.1021/acs.jc… We introduce the lambda-adaptive biasing force (ABF) method for the computation of alchemical free-energy

This is now published in The Journal of Physical Chemistry ! 🥳 CBI Toulouse @IpbsToulouse CNRS Occitanie Ouest CNRS Biologie pubs.acs.org/doi/10.1021/ac…

Excited to announce the release of our preprint, "The Martini 3 Lipidome: Expanded and Refined Parameters Improve Lipid Phase Behavior", now available on ChemRxiv: 👉 Read the full preprint here: chemrxiv.org/engage/chemrxi… and get the parameters here: github.com/Martini-Force-…