Re: [gmx-users] Gromacs Install problem

2020-03-14 Thread Paul bauer
Hello, if you have found a bug in the multi-dimensional array please report it on redmine.gromacs.org so we can fix it, together with the build configuration that causes it. Cheers Paul On 14/03/2020 00:51, Alexander Tzanov wrote: The new version from March 2020.1 is buggy. Try version

Re: [gmx-users] Gromacs Install problem

2020-03-13 Thread Alexander Tzanov
The new version from March 2020.1 is buggy. Try version 2020. There is another bug in multidimensional array ... Alex On Mar 13, 2020 1:54 PM, xuan Zhang wrote: Hi, When I install the Gromacs on Linux, the cmake occurs error like below. I am a newer on this software. I appreciate very much

Re: [gmx-users] Gromacs Install problem

2020-03-13 Thread Alexander Tzanov
For that error you may use normal and better Intel compiler or gcc above 6.3. The 2020.1 compiles well after correcting stupid bug in multidimensional array routine and with use of Intel 19 and gcc above 6. I use 7.3 Your compiler is too old to support C++14 but there other problem as well

Re: [gmx-users] Gromacs Install problem

2020-03-13 Thread xuan Zhang
Hi, For now, I have added the compiler to cmake and it works. But in the *make *step, the errors were shown as below. Thank you very much. Best regards, Xuan src/gromacs/CMakeFiles/lmfit_objlib.dir/build.make:79: recipe for target

[gmx-users] Gromacs Install problem

2020-03-13 Thread xuan Zhang
Hi, When I install the Gromacs on Linux, the cmake occurs error like below. I am a newer on this software. I appreciate very much that you can help me. Best regards, Xuan **/gromacs-2020.1/build$ cmake .. -DGMX_BUILD_OWN_FFTW=ON -DREGRESSIONTEST_DOWNLOAD=ON CMake Error at