NAMD

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Description

NAMD website  
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Fastest Fourier Transform in the West, is a C library for computing the Discrete Fourier Transform (DFT) in one or more dimensions, of arbitrary input size, and of both real and complex data. Developed at MIT, it is by far the fastest implementation of FFT algorithm (upheld by regular benchmar

Required Modules

Modules documentation

Parallel

  • intel
  • openmpi
  • fftw
  • namd

Parallel with CUDA

  • intel
  • openmpi
  • fftw
  • cuda
  • namd

Citation

If you publish research that uses NAMD you may want to cite it as follows:

"A Fast Fourier Transform Compiler," by Matteo Frigo, in the Proceedings of the 1999 ACM SIGPLAN Conference on Programming Language Design and Implementation (PLDI '99), Atlanta, Georgia, May 1999