[gmx-users] Re: Turn on pdb output after every step

santhosh mesanthu at gmail.com
Tue Jan 15 15:05:45 CET 2013

@Bogdan : It differs from the normal gromacs setup as this PDB write is
expected to happen during the run. (While the simulation is still running).
I have posted this in gmx-developers post as I felt its more apt after
Justins advice. 

View this message in context: http://gromacs.5086.n6.nabble.com/Turn-on-pdb-output-after-every-step-tp5004542p5004586.html
Sent from the GROMACS Users Forum mailing list archive at Nabble.com.

More information about the gromacs.org_gmx-users mailing list