That's the equivalent of 500 million years of evolution being processed by AI, the research team estimates, and it opens the way to creating custom-made proteins that can be designed for specific uses ...

A team of researchers designed AI model capable of generating new proteins, trained on a simulation of 500 million years of ...

The protein was then synthesized and tested in the lab. It glowed—a clear sign of success. The AI had effectively charted a ...

Molecular dynamics simulations play a crucial role in understanding peptide-protein interactions (PpIs), which are essential for various biological processes, including cell signaling. These ...

Scientists have developed a simulation method incorporating quantum mechanics to model the electronic structure of nearly ...

Beyond the new insights into Huntington's disease, we have developed tools that make molecular simulations more accessible to researchers worldwide," says Miettinen. This type of protein clumping ...

It’s been trained on 771 billion unique tokens – the AI term for a unit of data – taken from databases of natural protein ...

Enhanced sampling (ES) simulations of biomolecular recognition, such as binding small molecules to proteins and nucleic acid targets, protein–protein association, and protein-nucleic acid interactions ...

Evolution has been fine-tuning life at the molecular level for billions of years. Proteins, the fundamental building blocks of life, have evolved through this process to perform various biological ...

Wageningen researchers have discovered that a vital plant protein originated more than 600 million years ago, long before the ...

The Supporting Information is available free of charge at https://pubs.acs.org/doi/10.1021/acs.jpcb.4c07282. Simulation movie of FUS droplet wetting an actin filament ...