GROMACS - E-HPC
Documentation
/water_GMX50_bare.tar.gz$ tar xzvf water_GMX50_bare.tar.gz1. Submit the PBS job to run the water example: - For PBS job script of high ...
LAMMPS - E-HPC
Documentation
236salloc: Waiting for resource configurationsalloc: Nodes s[02-03] are ready for jobLAMMPS (31 Mar 2017)
Submit PBS jobs (GPU ...