Re: [gmx-users] Compiling Gromacs 2018 using Intel 2018.1 compiler on OSX 10.13.3

Hi, We haven't tried to build with icc on Mac, but as you say the problem is likely with that version of icc there. The icc 18 compiler works fine on Linux and Windows... Check for an updated version, or use gcc. Mark On Fri, Jan 26, 2018, 18:32 Zhiyi Wu wrote: > Hi,

[gmx-users] Compiling Gromacs 2018 using Intel 2018.1 compiler on OSX 10.13.3

Hi, I’m trying to compile Gromacs 2018 with icc 2018.1.126 on a iMac using flag cmake .. -DCMAKE_C_COMPILER=icc -DCMAKE_CXX_COMPILER=icpc -DGMX_GPU=on -DGMX_USE_OPENCL=on -DGMX_SIMD=AVX2_256 -DGMX_FFT_LIBRARY=mkl -DREGRESSIONTEST_DOWNLOAD=ON The cmake succeed without any warning but during the