[gmx-users] initial velocities
mahmaz71 at gmail.com
Wed Dec 24 21:26:36 CET 2014
Many thanks Tsjerk and Justin! You both helped alot.
On Wed, Dec 24, 2014 at 10:10 PM, mah maz <mahmaz71 at gmail.com> wrote:
> Thank you very much Tsjerk! As far as I know .gro files are coordinate
> ones, containing the structure of the system. How is it possible to make
> difference between x,y and z AND vx,vy and vz? Should I write the file like
> coordinate format?
> On Wed, Dec 24, 2014 at 7:44 PM, mah maz <mahmaz71 at gmail.com> wrote:
>> Dear all,
>> I want to apply an initial velocity to my system. Is there a possible
>> way rather than gen_vel in which I can chose my own wanted velocities?
>> And if so, how can I introduce the vx,vy and vz for the atoms?
>> thank you
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