[gmx-users] how to set "gen_vel" in mdp file and continue a crashed run

Jian Zou zouj01 at mails.tsinghua.edu.cn
Tue May 24 13:44:18 CEST 2005

Xavier wrote:
>> Then the last frame will be used? or the nearest output frame to the
>> last?
> What is the difference between the two ??
> tpbconv will use the last complet frame the trr file contains !

I wanted to know if I use different nst for coordinates and velocity, eg. 
"nstxout=1000" "nstvout=10000".

I tried and found that tpbconv will use the last complete frame with both 
coordinates and velocities in trr.

Thank you again, Xavier.


Jian Zou

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