Re: [gmx-users] the CPU of REMD

2012-10-18 Thread Terry
The TOTAL number of cores is specified by -np option. So it's 8 in all. By the way, you can submit the job to see how. It'd be faster than waiting on the list. Terry On Thu, Oct 18, 2012 at 3:20 PM, Albert wrote: > hello: > I've got a qeustion the CPU for replica exchange. it said the REMD >

[gmx-users] the CPU of REMD

2012-10-18 Thread Albert
hello: I've got a qeustion the CPU for replica exchange. it said the REMD should be performed by command: mpiexec -x -np 8 mdrun -s sd_.tpr -multi 8 -preplex 1000 the above command have 8 different temperature and it specify 8 cores. Does it mean the mdrun will use 1 core (8 in all) for eac