Search Results for author: Daniel Reynolds

Found 1 papers, 0 papers with code

Optimized Parallelization of Boundary Integral Poisson-Boltzmann Solvers

no code implementations30 Nov 2023 Xin Yang, Elyssa Sliheet, Reece Iriye, Daniel Reynolds, Weihua Geng

By considering the advantages of current algorithms and computer hardware, we focus on the parallelization of the treecode-accelerated boundary integral (TABI) PB solver using the Message Passing Interface (MPI) on CPUs and the direct-sum boundary integral (DSBI) PB solver using KOKKOS on GPUs.

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