A single autoregressive neural model now learns molecular ground states from sparse anchor geometries, achieving chemical accuracy at untrained configurations with 25.8× GPU-cost reduction compared to independent optimization.

A single autoregressive neural model now learns molecular ground states from sparse anchor geometries, achieving chemical accuracy at untrained configurations with 25.8× GPU-cost reduction compared to independent optimization.
Centre National de la Recherche Scientifique is hiring:
Postdoctoral Researcher in Molecular Chemistry
Universite de Strasbourg is hiring:
Post-Doctoral Position in Molecular Modelling
Universidade de Santiago de Compostela is hiring:
Associated Research Staff for the development of biologically relevant models to study nanomaterials