Chemistry, Computational Chemistry, Molecular Dynamics, Gromacs, Programming.
the latest (3.3.9). If you wish to use FFTW3, download the 64-bit version zip and extract into a folder. For the usual build of GROMACS, the single precision FFTW3 library is required. As MSVC++ compiler is being used here, the library needs to be present in import library format (.lib), which is