git clone https://github.com/fireball-QMD/progs
cd progs
export FIREBALLHOME=$(pwd)
make libfireball
cd ~
tar -xvf AmberTools20.tar.gz
cd amber20_src
export AMBERHOME=$(pwd)
export MKL_HOME=$MKLROOT
./configure -fireball -noX11 intel
make install
fireball_20.05_ambertools_20.txt · Last modified: 2020/05/25 17:06 by dani