New paper published in the Journal of Chemical Theory and Computation: Faster Molecular Dynamics with Neural Network Potentials via Distilled Multiple Time-Stepping and Non-Conservative Forces.N. [...]

And that's a wrap! The 2026 Tinker Developer Meeting returned to Paris, hosted at Sorbonne Université from June 1st to 3rd 2026. Following the tradition [...]

Check the new paper published in the Journal of Physical Chemistry Letters: Accelerating Molecular Dynamics Simulations with Foundation Neural Network Models using Multiple Time-Step and [...]

💫 We just released the weights of the FeNNixBio1 foundation machine learning model for drug design! 💫 Weights: https://github.com/FeNNol-tools/FeNNol-PMC FeNNol code: https://github.com/FeNNol-tools/FeNNol The models are [...]