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Simple parallel molecular dynamics simulation of a Lennard-Jones fluid in Rust πŸ¦€

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Compizfox/md-rs

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md-rs

Simple molecular dynamics simulation of a Lennard-Jones fluid written from scratch in Rust πŸ¦€ as a exercise

  • Fully parallel integration and force computation using Rayon multi-threading
  • Extensible integrators, potentials, and thermostats
  • (Gzipped) XYZ trajectory output

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Simple parallel molecular dynamics simulation of a Lennard-Jones fluid in Rust πŸ¦€

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