A new Nature Physics study has shed light on the long-hypothesized liquid-liquid critical point where water simultaneously exists in two distinct liquid forms, opening new possibilities for ...
This important study characterizes the mechanics and stability of bolalipids from archaeal membranes using molecular dynamics simulations. A mesoscale model of bolalipids is presented and evaluated ...
To contribute to chemical recycling, this study proposes a system that simulates the process of depolymerization from polymer-to-monomer using reactive molecular dynamics (MD ... We validated the ...
This paper reviews the methods, benefits and challenges associated with the adoption and translation of computational fluid dynamics (CFD ... Combined with cardiovascular imaging, CFD simulation ...
Example LAMMPS input file (examples/polymer_simulation.lammps) Git configuration (.gitignore) Container GPU performance testing AWS Batch job submission testing Checkpoint system validation Spot ...
Water pollution is one of the growing challenges of modern life. Many everyday items, from medications to cosmetics, leave behind residues that don't fully break down after use. These pollutants ...
Centre for Computational Science, University College London, 20 Gordon Street, London WC1H 0AJ, U.K. Centre for Computational Science, University College London, 20 Gordon Street, London WC1H 0AJ, U.K ...
The Sims 4's decade-long reign as the king of life sims finally has a worthy contender for the crown. Krafton's upcoming PC game inZOI is no ordinary life sim; as its meta narrative framing puts ...
A CLI tool for Molecular Dynamics pre- and post-processing, Meant to be used with Large Scale Atomic/Molecular Massively Parallel Simulator (LAMMPS).
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