Re: [gmx-users] About the -multi option in mdrun

2008-12-18 Thread David van der Spoel
Lee Soin wrote: Hello! How to specify the -multi option when doing REMD with mdrun? It seems that this option has changed from bool to int type in version 4.0. mpirun -np 24 mdrun -multi 4 will start 4 jobs at 6 processors each. -- Sun Li Department of Physics Nanjing University, China --

[gmx-users] About the -multi option in mdrun

2008-12-18 Thread Lee Soin
Hello! How to specify the -multi option when doing REMD with mdrun? It seems that this option has changed from bool to int type in version 4.0. -- Sun Li Department of Physics Nanjing University, China ___ gmx-users mailing listgmx-users@gromacs.org