GALAMOST: GPU-accelerated large-scale molecular simulation toolkit

Abstract

GALAMOST [graphics processing unit (GPU)-accelerated large-scale molecular simulation toolkit] is a molecular simulation package designed to utilize the computational power of GPUs. Besides the common features of molecular dynamics (MD) packages, it is developed specially for the studies of self-assembly, phase transition, and other properties of polymeric… (More)
DOI: 10.1002/jcc.23365

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