Hi,
I was trying to install CHAP on Ubuntu 22.04 with gcc-11. Unfortunately, it didn't work due to incompatibility issues with gcc-11 and gromacs-2022. I found a solution and I wanted to post it here just in case someone else encounters it. I installed gcc-9 with 'sudo apt install gcc-9 g++-9'. Then, I compiled gromacs-2018 with the following command:
cmake .. -DREGRESSIONTEST_DOWNLOAD=OFF -DGMX_GPU=OFF -DCMAKE_INSTALL_PREFIX=/usr/local/gromacs-2018/ -DCMAKE_C_COMPILER=gcc-9 -DCMAKE_CXX_COMPILER=g++-9 -DGMX_HWLOC=OFF
Finally, I compiled CHAP with gcc9 using the following cmake setup:
cmake .. DCMAKE_C_COMPILER=gcc-9 -DCMAKE_CXX_COMPILER=g++-9
I hope this may help people who want to compile it.
Best,
Mustafa
Hi,
I was trying to install CHAP on Ubuntu 22.04 with gcc-11. Unfortunately, it didn't work due to incompatibility issues with gcc-11 and gromacs-2022. I found a solution and I wanted to post it here just in case someone else encounters it. I installed gcc-9 with 'sudo apt install gcc-9 g++-9'. Then, I compiled gromacs-2018 with the following command:
cmake .. -DREGRESSIONTEST_DOWNLOAD=OFF -DGMX_GPU=OFF -DCMAKE_INSTALL_PREFIX=/usr/local/gromacs-2018/ -DCMAKE_C_COMPILER=gcc-9 -DCMAKE_CXX_COMPILER=g++-9 -DGMX_HWLOC=OFF
Finally, I compiled CHAP with gcc9 using the following cmake setup:
cmake .. DCMAKE_C_COMPILER=gcc-9 -DCMAKE_CXX_COMPILER=g++-9
I hope this may help people who want to compile it.
Best,
Mustafa