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Check out my new work with Frank Noe where we answer if the structure of different protein conformations really can be predicted. nature.com/articles/s4146… Also try the Colab to see if your protein has different conformations: colab.research.google.com/github/patrick…

An absolutely remarkable #Covid paper from UCSF. What did they find? 1. Fibrin binds spike protein 2. Forms proinflammatory blood clots 3. Clots drive systemic thromboinflammation & brain pathology, including #LongCovid 4. NK cell loss is seen & explains increase in #cancer

A while back I was screaming for another paper, how did this paper pass peer-review in Nature Communications . Here is another one. Read the comments.

Excited to see our work on accelerating DeepLNE++ published in The Journal of Chemical Physics at doi.org/10.1063/5.0226… The updated link for tutorials: github.com/ThorbenF/DeepL… Many thanks to Valerio Rizzi, Simone Aureli, and the entire Gervasio's Research Group (Protein Dynamics). Summary below: x.com/TFroehlking/st…

Our commentary "A renewed call for open artificial intelligence in biomedicine" is now available as a preprint. We call for sharing training data, code, and model weights in biomedical artificial intelligence research. 1/

Looking for an accurate and transferable strategy to calculate protein-ligand absolute binding free energies? Check out our latest paper now published in The Journal of Physical Chemistry with Maurice Karrenbrock Valerio Rizzi Dom Simone Aureli Gervasio's Research Group (Protein Dynamics) doi.org/10.1021/acs.jp… 1/🧵

Congratulations to David Baker, Demis Hassabis and John Jumper!

I said that reaching Human-Level AI "will take several years if not a decade." Sam Altman says "several thousand days" which is at least 2000 days (6 years) or perhaps 3000 days (9 years). So we're not in disagreement. But I think the distribution has a long tail: it could take

Much of the success of breakthroughs, such as AlphaFold, is thanks to a database of protein structures dreamed up in the 1960s by Helen Berman go.nature.com/4hp4UCP

Valentin Miéville is one of the 2024 winners of the "#PhD Booster" programme launched by the Faculty of Medicine, which aims to promote young talent in #biomedical #research. His research "Small organs, great outcome: organoids against kidney cancer" youtu.be/DwFx5W7IonM

What is happening? HandMol is happening! Coming soon, multiuser, immersive, interactive simulations.

🔴 LIVE in 25 minutes: Computational Protein Design Then & Now (1988-2024) A free one-hour webinar featuring: David Baker (UW) Steve Mayo (Caltech) Bill DeGrado (UCSF) Brian Kuhlman (UNC) youtube.com/live/BuJGTn7Oh…

We are moving to #Bluesky #bsky and LinkedIn. Follow us there if you are interested in our latest works and news: bsky.app/profile/gervas…

An initiative coordinated by Gareth Tribello, Max Bonomi, Giovanni Bussi, Carlo Camilloni, and with fundamental contributions from our community. 𝕏 handles in 🧵:

Happy New Year tweeps! A new review article in collaboration with Pande's lab at Johnson & Johnson and Gervasio's Research Group (Protein Dynamics) at Université de Genève on "Computational advances in discovering cryptic pockets for drug discovery" is now live Current Opinion/Research in Structural Biology Elsevier sciencedirect.com/science/articl…

What do Professors do after a meeting at the Olympic park? - Go on a slide. Gervasio's Research Group (Protein Dynamics)

Our contribution in #JACS: deep-learning-guided simulations to detect the molecular mechanism for DNA translocation during nucleic acid polymerization. We loved it ! 😊 Congrats to co-authors! Take a look please ! In collab with Parrinello Group pubs.acs.org/doi/10.1021/ja…

The corresponding News & Views from Gervasio's Research Group (Protein Dynamics), Thorben Fröhlking and Simone Aureli is now live! nature.com/articles/s4358… 🔓rdcu.be/exl41