Molecular modelling encompasses all theoretical methods and computational techniques used to mimic and study the structure and behaviour of molecules, ranging from small chemical systems to large ...

Toolkit for multiscale modeling with LAMMPS in Python 3.x. It integrates with LAMMPS-GUI and leverages Large Language Models for rapid prototyping.

Royalty-free licenses let you pay once to use copyrighted images and video clips in personal and commercial projects on an ongoing basis without requiring additional payments each time you use that ...

Quantum spin liquids (QSLs) are fascinating and mysterious states of matter that have intrigued scientists for decades. First proposed by Nobel laureate Philip Anderson in the 1970s, these ...

Laboratoire de Biologie et Modélisation de la Cellule, CNRS, UMR 5239, Inserm, U1293, Université Claude Bernard Lyon 1, Ecole Normale Supérieure de Lyon, 46 Allée d’Italie, 69364 Lyon, France Centre ...

An artificial intelligence model has created a new protein that researchers say would have taken 500 million years to evolve in nature — if nature were capable of producing such a thing.

Institute of Physics, University of Brasília, 70910-900 Brasília-DF, Brazil Computational Materials Laboratory, University of Brasília, 70910-900 Brasília-DF, Brazil Physics Postgraduate Program, ...

AtomProNet | ├── Data collection from materials project database │ │ │ ├── Atomic energy, position, lattice parameters ... distributions │ └── Classical Molecular Dynamics (LAMMPS) │ └── Computational ...

The drug restored the cholinergic system and improved memory,” added Moreno. Rafael Rodríguez believes that “this molecule could become a drug to treat the symptoms of dementia, at least during the ...