The detailed information of this precompiled GROMACS is given in this link, which contains output of gmx -version. In that case, you have to compile your own GROMACS, under your local machine. *Note: If your CPU or GPU is older than mine or using AMD CPU or GPU, GROMACS may not be running properly. Usage: Unzip this file with appropriate destination, and run the gromacs.bat I precompiled the GROMACS 2021.2 version, under Windows 10 64bit, VS 2019, CUDA 11.3, and FFTW 3.3.5 environment. However, I did not test that WSL environment can perform GPU computation in GROMACS. If you are interested in this topic, please check the NVidia homepage. Update: In the developer version of Windows 10, WSL 2 provides CUDA environment. If you don't need the CUDA environment, or CUDA environment is working properly in the Cygwin or WSL, you can just follow up the "Quick and Dirty Installation" described in GROMACS hompage) (I am not sure that Cygwin or WSL can use the Windows' CUDA environment or GPU driver. This document briefly introduces how to intsall the GROMACS in Windows without Cygwin or Window subsystem for Linux (WSL), by using Visual Studio: "Native" environment, which is enable to use GPU (CUDA) computation.
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