Scalable Force Directed Graph Layout Algorithms Using Fast Multipole Methods

Author(s):  
Enas Yunis ◽  
Rio Yokota ◽  
Aron Ahmadia
2013 ◽  
Vol 13 (1) ◽  
pp. 107-128 ◽  
Author(s):  
Bo Zhang ◽  
Benzhuo Lu ◽  
Xiaolin Cheng ◽  
Jingfang Huang ◽  
Nikos P. Pitsianis ◽  
...  

AbstractThis paper summarizes the mathematical and numerical theories and computational elements of the adaptive fast multipole Poisson-Boltzmann (AFMPB) solver. We introduce and discuss the following components in order: the Poisson-Boltzmann model, boundary integral equation reformulation, surface mesh generation, the nodepatch discretization approach, Krylov iterative methods, the new version of fast multipole methods (FMMs), and a dynamic prioritization technique for scheduling parallel operations. For each component, we also remark on feasible approaches for further improvements in efficiency, accuracy and applicability of the AFMPB solver to large-scale long-time molecular dynamics simulations. The potential of the solver is demonstrated with preliminary numerical results.


2006 ◽  
Vol 32 (10-11) ◽  
pp. 775-790 ◽  
Author(s):  
J. Kurzak ◽  
B. M. Pettitt

2017 ◽  
Vol 62 (8) ◽  
pp. 400-402
Author(s):  
A. M. Linkov ◽  
E. Rejwer ◽  
L. Rybarska-Rusinek

1998 ◽  
Vol 5 (3) ◽  
pp. 32-38 ◽  
Author(s):  
L. Greengard ◽  
Jingfang Huang ◽  
V. Rokhlin ◽  
S. Wandzura

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