Ionic liquids (ILs) are a class of molten salts with a collection of exciting properties, which have been employed for ...

Machine learning and supercomputer simulations help researchers to predict interactions between gold nanoparticles and blood proteins Date: November 19, 2024 Source: University of Jyväskylä ...

News Release 18-Nov-2024 Machine learning and supercomputer simulations help researchers to predict interactions between gold nanoparticles and blood proteins Peer-Reviewed Publication ...

More information: Sandro Wieser et al, Machine learned force-fields for an Ab-initio quality description of metal-organic frameworks, npj Computational Materials (2024).

An international team led by Einstein Professor Cecilia Clementi in the Department of Physics at Freie Universität Berlin introduces a breakthrough in protein simulation.

Simulations Plus announced today a new collaboration to enhance ADMET Predictor, its preeminent property prediction platform for drug discovery.

This machine learning model takes MOF simulations to the next level The MOFTransformer model takes inspiration from the same technology that powers ChatGPT by Ariana Remmel March 30, 2023 3 min read ...