[gmx-users] Error using double precision

edvin.erdtman at nat.oru.se edvin.erdtman at nat.oru.se
Mon Aug 20 13:25:38 CEST 2007

> >Ok (you didn't say that in the first mail...).
> >Does it also happen on one processor?
> I Haven't tested in d.p.
> >After how many steps does it happen? (see Marks mail).
> after 300000 steps, that is 600 ps.
> I energy minimized the system in d.p. and it is still running after 
> 710 ps. 

No had stopped at 710 ps...

Why is it then working with single precision?


More information about the gromacs.org_gmx-users mailing list