diff --git a/Dockerfile b/Dockerfile index a4bcf3d..4f1503d 100644 --- a/Dockerfile +++ b/Dockerfile @@ -8,7 +8,7 @@ USER ${NB_USER} RUN mkdir /home/${NB_USER}/opt -RUN cd /home/${NB_USER}/opt && git clone https://github.com/lammps/lammps && cd lammps/src && make lib-pace args="-b" && make yes-ml-pace && make yes-manybody && make lib-voronoi args="-b" && make yes-voronoi && make serial +RUN cd /home/${NB_USER}/opt && git clone https://github.com/lammps/lammps && cd lammps/src && make lib-pace args="-b" && make yes-molecule && make yes-reaxff && make yes-rigid && make yes-ml-pace && make yes-manybody && make lib-voronoi args="-b" && make yes-voronoi && make serial USER root