Installation of g_mmpbsa with Gromacs 2016.3

[Jo Hr]

Dear mmpbsa-Users,

I want to install g_mmpbsa using my current 2016.3 gromacs gmx_mpi installation and my already installed apbs 1.4.1.
First of all, in the installation instruction of g_mmpbsa it says, that gromacs 4.6.x should be installed with -DGMX_GPU=off. Will it work with my 2016.3 version, where I use gpu acceleration?
Has anyone a similar configuration and tried installation of g_mmpbsa the following way:

cd g_mmpbsa
mkdir build
cd build
cmake -DGMX_PATH= PATH/TO/GROMACS \
-DAPBS14=on \
-DAPBS_INSTALL=PATH/TO/APBS \
-DCMAKE_INSTALL_PREFIX=/opt/g_mmpbsa \
..
make
sudo make install


Thank you very much in advance for your help!

All the best
Johannes

[g_mmpbsa Mailing List]

Hello,

Presently, g_mmpbsa cannot be compiled with Gromacs-2016 or newer versions. You have to make a new tpr with lower version and use with g_mmpbsa.