TweTriS: Twenty trillion-atom simulation

Fluid phase interface properties of acetone, oxygen, nitrogen and their binary mixtures by molecular simulation

(2015) Stefan Eckelsbach et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Significance of Molecular Dynamics Simulations for Life Sciences

(2014) Martin Karplus et al.   ISRAEL JOURNAL OF CHEMISTRY

ls1 mardyn: The Massively Parallel Molecular Dynamics Code for Large Systems

(2014) Christoph Niethammer et al.   Journal of Chemical Theory and Computation

A flexible algorithm for calculating pair interactions on SIMD architectures

(2013) Szilárd Páll et al.   COMPUTER PHYSICS COMMUNICATIONS

Biomolecular Simulation: A Computational Microscope for Molecular Biology

(2012) Ron O. Dror et al.   Annual Review of Biophysics

Implementing molecular dynamics on hybrid high performance computers – short range forces

(2010) W. Michael Brown et al.   COMPUTER PHYSICS COMMUNICATIONS

A Review of Computational Methods in Materials Science: Examples from Shock-Wave and Polymer Physics

(2009) Martin Steinhauser et al.   INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

TRILLION-ATOM MOLECULAR DYNAMICS BECOMES A REALITY

(2008) TIMOTHY C. GERMANN et al.   INTERNATIONAL JOURNAL OF MODERN PHYSICS C