GALAMOST: GPU-accelerated large-scale molecular simulation toolkit
classification
⚛️ physics.comp-ph
cond-mat.softphysics.chem-ph
keywords
toolkitmodelsmolecularself-assemblysimulationadditionanisotropiccomposed
read the original abstract
A new molecular simulation toolkit composed of some lately developed force fields and specified models is presented to study the self-assembly, phase transition, and other properties of polymeric systems at mesoscopic scale by utilizing the computational power of GPUs. In addition, the hierarchical self-assembly of soft anisotropic particles and the problems related to polymerization can be studied by corresponding models included in this toolkit.
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