The objective of this project is to simulate a coarse-grained protein in multiple types of solvents. We will do this by using LAMMPS to establish the interactions between different types of particles ...

The simulation revealed that liquid argon atoms don't undergo simple Brownian motion, but instead show complex dynamics including temporary "caging" by neighbors and subsequent escape—insights ...

LAMMPS is one of the most widely used tools for running simulations for research in molecular dynamics. While the tool itself is fairly easy to use, more often than not you’ll need to customize it to ...