[gmx-users] print out the velocities and forces using template.c

Tsjerk Wassenaar tsjerkw at gmail.com
Fri Nov 28 10:41:25 CET 2008

Hi Qiang,

You'll have to check whether the frame contains velocities (fr.bV ==
TRUE) or forces (fr.bF == TRUE). Also make sure you set the flags
right to read velocities/forces. Check the source of g_traj or trjconv
for examples.



On Fri, Nov 28, 2008 at 10:33 AM, Mark Abraham <Mark.Abraham at anu.edu.au> wrote:
> friendli wrote:
>> Dear all users,
>> A silly question:
>> I want to print out the velocities and forces in the trajectories using
>> template.c.
> g_traj or gmxdump do that.
> Mark
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Tsjerk A. Wassenaar, Ph.D.
Junior UD (post-doc)
Biomolecular NMR, Bijvoet Center
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
P: +31-30-2539931
F: +31-30-2537623

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