GALAMOST: GPU-accelerated large-scale molecular simulation toolkit

• Published in: Journal of computational chemistry Vol. 34; no. 25; pp. 2197 - 2211
• Main Authors: Zhu, You-Liang, Liu, Hong, Li, Zhan-Wei, Qian, Hu-Jun, Milano, Giuseppe, Lu, Zhong-Yuan
• Format: Journal Article
• Language: English
• Published: United States Blackwell Publishing Ltd 30.09.2013; Wiley Subscription Services, Inc
• Subjects: 1,2-Dipalmitoylphosphatidylcholine - chemistry; Charged particles; Computer Graphics; Density; Models, Molecular; Molecular Dynamics Simulation - standards; Molecular structure; Particle Size; Polymerization; Polymers; Polymers - chemistry; polymers MD GPU anisotropic particles polymerization

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‐ass...