wenyan4work's repositories
SphereSimulator
A boundary integral simulation tool based on spherical harmonics
PeriodicFMM
The periodic wrapper and operator data generator to be used with PVFMM
SimToolbox
A toolbox for object-tracking simulation
mini-nbody
A simple gravitational N-body simulation in less than 100 lines of C code, with CUDA optimizations.
FDPS
Github repository for FDPS
forcebalance
Systematic force field optimization.
mlinterp
Fast arbitrary dimension linear interpolation in C++
openff-evaluator
A physical property evaluation toolkit from the Open Forcefield Consortium.
point_cloud
A tiny python script to compute rdf and structure factor for 2D/3D periodic isotropic point cloud
recip_rsqrt_benchmark
Benchmark of vectorized implementations of (1/x) and (1/sqrt(x))
SE_unified
The Spectral Ewald method for a wide range of kernels.
SlurmSub
Slurm job submission scripts with proper thread binding